SANC01122 Acetovanillone




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MCULE-4549346345 1 C1(C=CC(=C(OC)C=1)O)C(C)=O
MolPort-000-000-274 1 COc1cc(ccc1O)C(C)=O
MCULE-5774770339 0.96 C1(=CC=C(C(OC)=C1)OC)C(C)=O
MolPort-000-871-220 0.96 COc1ccc(cc1OC)C(C)=O
MCULE-7881518363 0.92 C1(O)=C(OC)C=C(C=C1OC)C(C)=O
MCULE-5440459401 0.92 C1(=CC=C(C(O)=C1)OC)C(C)=O
MolPort-001-759-184 0.92 COc1cc(cc(OC)c1O)C(C)=O
MolPort-002-462-187 0.91 COc1ccc(cc1O)C(C)=O
MCULE-7643685693 0.90 COC1=C(OC)C=C(C(C)=O)C(C)=C1
MCULE-9461577093 0.90 C1(=CC=C(C(OC)=C1)O)C(C1C=CC=CC=1)=O
MolPort-027-844-889 0.90 COc1cc(cc(O)c1OC)C(C)=O
MolPort-001-766-441 0.90 COc1cc(C)c(cc1OC)C(C)=O
MCULE-4938616366 0.89 C1(=CC=CC(OC)=C1)C(C)=O
MolPort-000-156-738 0.89 COc1cccc(c1)C(C)=O
MCULE-3610198972 0.88 COC1=C(OC)C(OC)=CC(C(C)=O)=C1
MCULE-7348586424 0.88 C1(C=CC(=C(OC)C=1)O)C(CC)=O
MCULE-7524743079 0.88 COC1=C(O)C(C(C)=O)=CC=C1
MolPort-000-797-489 0.88 CCC(=O)c1ccc(O)c(OC)c1
MolPort-000-881-380 0.88 COc1cc(cc(OC)c1OC)C(C)=O
MolPort-001-787-695 0.88 COc1cccc(C(C)=O)c1O
MolPort-044-594-143 0.87 COc1cc(cc2ccccc12)C(C)=O
MolPort-003-663-914 0.87 COc1ccc(cc1)C(=O)c1ccc(OC)c(OC)c1
MolPort-039-013-457 0.87 COc1cc(C(C)=O)c(O)cc1O
MCULE-1172777519 0.87 COC1=C2C(C=CC=C2)=CC(C(C)=O)=C1
MCULE-6526749560 0.87 C1(=CC=C(C(OC)=C1)OC)C(=O)C1C=CC(=CC=1)OC
MCULE-6864508385 0.87 COC1=C(OC)C(C)=C(C(C)=O)C=C1
MCULE-9712194535 0.87 C1(C(C)=O)=CC(C)=C(C(OC)=C1)OC
MCULE-1972034934 0.87 C1C(C(C2=CC=CC=C2)=O)=CC(OC)=C(OC)C=1
MCULE-5256572783 0.87 C1C(O)=C(OC)C=C(C(=O)C)C=1O
MCULE-2470448231 0.87 C(=O)(C1=CC=CC(OC)=C1)C1=CC=C(OC)C(OC)=C1
MCULE-7675320577 0.87 C(=O)(C1=CC=C(C(OC)=C1)OC)C1C=CC(=C(OC)C=1)OC
MolPort-000-160-337 0.87 CCc1cc(OC)c(O)c(C=O)c1
MolPort-003-719-652 0.87 COc1ccc(cc1OC)C(=O)c1ccc(OC)c(OC)c1
MolPort-000-881-836 0.87 COc1ccc(cc1OC)C(=O)c1ccccc1
MolPort-001-787-617 0.87 COc1ccc(C(C)=O)c(C)c1OC
MolPort-003-179-204 0.86 COc1cccc(c1)C(=O)c1ccc(O)cc1
MCULE-4857445795 0.86 C(=O)(C1C=CC(=CC=1)O)C1=CC=CC(OC)=C1
MolPort-003-737-978 0.85 COc1ccc(cc1OC)C(=O)C(C)C
MolPort-001-757-335 0.85 O.COc1ccc(cc1OC)C(=O)C=O
MolPort-000-881-059 0.85 COc1ccc(C(C)=O)c(O)c1OC
MolPort-002-466-079 0.85 CCOc1ccc(cc1OCC)C(C)=O
MolPort-003-738-095 0.85 COc1ccc(cc1)C(=O)c1cccc(OC)c1
MolPort-000-160-732 0.85 CCC(=O)c1ccc(OC)c(OC)c1
MolPort-029-806-043 0.85 CCOc1cc(ccc1OC)C(C)=O
MCULE-7067567406 0.85 CCOC1=C(OCC)C=C(C(C)=O)C=C1
MCULE-1572994134 0.85 C1(C=CC(=C(OC)C=1)OC)C(C(C)C)=O
MCULE-5644480125 0.85 C1(=C(OC)C=C(C=C1)C(C=O)=O)OC
MCULE-8147619275 0.85 C1(O)=C(OC)C(OC)=CC=C1C(C)=O
MCULE-8346047035 0.85 C1(=CC=C(OC)C(OC)=C1)C(=O)C(C)(C)C
MCULE-9971345349 0.85 C(=O)(C1=CC=C(OC)C(OC)=C1)C1C=CC=C2C=CC=CC=12
MCULE-9679861007 0.85 C1(=CC=C(C(OC)=C1)OC)C(CC)=O
MCULE-8281800760 0.85 O(CC)C1=CC(C(C)=O)=CC=C1OC
MCULE-7094036771 0.85 C(=O)(C1C=CC2=CC(OC)=CC=C2C=1)C1=CC=C(C(OC)=C1)OC
MCULE-8306453505 0.85 C1(C=CC=C(OC)C=1)C(=O)C1=CC=C(OC)C=C1
MolPort-042-681-381 0.84 COc1cc(O)cc(c1)C(C)=O
MolPort-009-684-793 0.84 COc1cc(C)cc(c1)C(C)=O
MCULE-3122789986 0.84 COC1C=C(C(=O)C)C=C(C)C=1
MCULE-7160372923 0.84 O=C(C)C1C=C(OC)C=C(O)C=1
MolPort-003-847-898 0.83 [2H]C([2H])([2H])Oc1cc(C=O)ccc1O
MolPort-000-165-443 0.83 COc1cc(C=O)ccc1O
MCULE-7796726237 0.83 C1(=CC=C(C(O)=C1)OC)C(C1C=CC=CC=1)=O
MCULE-1294709490 0.83 C1(OC)=CC(=CC=C1O)C=O
MolPort-001-768-683 0.82 CC(=O)c1ccc2OCOc2c1
MolPort-002-794-693 0.82 CCOc1cccc(c1)C(C)=O
MolPort-000-154-577 0.82 COc1cc(OC)cc(c1)C(C)=O
MolPort-001-508-572 0.82 CC(C)Oc1cccc(c1)C(C)=O
MolPort-002-558-756 0.82 COc1ccc(cc1OC)C(=O)c1ccc(OC)c2cccc(O)c12
MolPort-001-537-601 0.82 COc1cc(O)c(cc1OC)C(C)=O
MolPort-029-805-528 0.82 CCC(=O)c1cc(OC)c(O)c(OC)c1
MCULE-7528436203 0.82 C1(=CC=C(C(OC)=C1)OC)C(=O)C1C=CC(=CC=1)C(C)C
MCULE-7132665074 0.82 C1(OC)C=C(C=CC=1OC)C(=O)CN
MCULE-5923247624 0.82 C1(=CC=C(C(OC)=C1)OC)C(=O)C1=CC=C(CC)C=C1
MCULE-6249103616 0.82 C1(C=CC(=C2C=CC=C(O)C=12)OC)C(=O)C1=CC=C(C(OC)=C1)OC
MCULE-9098668931 0.82 C1(OC)=C(OC)C=C(C(C2C=CC(C)=CC=2)=O)C=C1
MCULE-3407651420 0.82 C1=C(C=CC(C(=O)C2=CC=C(OC)C(OC)=C2)=C1)C(C)(C)C
MCULE-6417700618 0.82 C1(=CC=C(C(OC)=C1)OC)C(=O)C1=CC=C(C=C1)OC(C)(C)C
MCULE-3015827434 0.82 CCC(C1=CC(OC)=C(O)C(OC)=C1)=O
MCULE-7797232934 0.82 CC(C1=CC2=C(OCO2)C=C1)=O
MCULE-8919794743 0.82 C1(C(C)=O)C=C(OC)C(=CC=1O)OC
MCULE-5693143585 0.82 C1(=CC=C(OC)C(OC)=C1)C(=O)C1=CC=C(C=C1)OCC
MCULE-2625221868 0.82 C1(C=CC=C(OC(C)C)C=1)C(C)=O
MCULE-8311400789 0.82 C1C(C(C)=O)=CC(=CC=1OC)OC
MCULE-8106274239 0.82 C1(C=CC=C(OCC)C=1)C(C)=O
MolPort-044-809-423 0.81 COc1ccc(C(C)=O)c2c(OC)ccc(C(C)=O)c12
MolPort-009-754-040 0.81 COc1ccc(C(C)=O)c(O)c1O
MolPort-000-151-949 0.81 COc1ccc(cc1OC)C(=O)CBr
MolPort-015-162-531 0.81 COc1ccc(cc1O)C(=O)c1cc(OC)c(OC)c(OC)c1
MolPort-002-506-748 0.81 [Cl-].COc1ccc(cc1OC)C(=O)C[NH3+]
MolPort-003-836-279 0.81 COc1ccc(cc1OC)C(=O)CCl
MolPort-000-164-241 0.81 Cl.COc1ccc(cc1OC)C(=O)CN
MolPort-022-379-189 0.81 COc1cc(ccc1O)C(=O)CCO
MolPort-020-393-659 0.81 Br.COc1ccc(cc1OC)C(=O)CN
MolPort-022-379-219 0.81 COc1cc(C(C)=O)c(OC)cc1O
MolPort-042-672-125 0.81 COc1ccc(cc1OC)C(=O)CI
MolPort-002-507-442 0.81 CCC(=O)c1ccc(OC)c(O)c1
MolPort-039-338-472 0.81 COc1cc(O)cc(C(C)=O)c1O
MolPort-008-513-046 0.81 COc1cccc(C(C)=O)c1OC
MCULE-4998849804 0.81 C1(=CC=C(C(O)=C1)OC)C(CC)=O
MCULE-3466813622 0.81 C1(C=CC=C(OC)C=1OC)C(C)=O
MCULE-3217202564 0.81 C1C(=C2C(C(=CC=C2C(C)=O)OC)=C(C(=O)C)C=1)OC
MCULE-8953094031 0.81 C1(O)C(O)=C(OC)C=CC=1C(C)=O
MCULE-8547342774 0.81 C1C(O)=CC(C(=O)C)=C(O)C=1OC
MCULE-1793197026 0.81 C1(=CC(OC)=C(C(OC)=C1)OC)C(=O)C1=CC=C(OC)C=C1
MCULE-5554452651 0.81 C1(=CC=C(C(OC)=C1)OC)C(=O)C1=CC=C(C=C1)OC1C=CC=CC=1
MCULE-7186777498 0.81 C1(=CC(OC)=C(C(OC)=C1)OC)C(=O)C1C=C(C=C(OC)C=1)OC
MCULE-8887038662 0.81 C1(OC)=C(OC)C=C(C(C2C=CC=C(C)C=2)=O)C=C1
MCULE-4872134533 0.81 [Cl-].C1(C=CC(=C(OC)C=1)OC)C(C[NH3+])=O
MCULE-9405831178 0.81 C1(=CC(OC)=CC(OC)=C1)C(=O)C1=CC=C(OC)C(OC)=C1
MCULE-8996656791 0.81 C1(=CC(OC)=C(C(OC)=C1)OC)C(=O)C1C=CC=C(OC)C=1
MCULE-3460162821 0.81 C(C1=CC(OC)=C(OC)C=C1)(C1=CC(OC)=C(OC)C(OC)=C1)=O
MCULE-3405501538 0.81 C1(=CC(C)=CC(C)=C1)C(=O)C1=CC=C(C(OC)=C1)OC
MCULE-7238289482 0.81 C(=O)(C1=CC=C(OC)C(O)=C1)C1=CC(OC)=C(OC)C(OC)=C1
MCULE-3433357367 0.81 C1(C=CC(=C(OC)C=1)OC)C(CI)=O
MCULE-9224916887 0.81 COC1=C(O)C=C(OC)C(C(C)=O)=C1
MCULE-2171995209 0.81 C1(C=CC(=C(OC)C=1)OC)C(CBr)=O
MCULE-4323163724 0.81 C1(OC)C=C(C(=O)CCO)C=CC=1O
MCULE-3918620813 0.81 C1(=CC(OC)=C(C(OC)=C1)OC)C(C1=CC=CC=C1)=O
MCULE-3132226749 0.81 C1(=CC=C(C(OC)=C1)OC)C(CCl)=O
MolPort-022-383-556 0.80 COc1ccc(C=O)c(C(C)C)c1OC
MolPort-046-689-717 0.80 [2H]C([2H])([2H])C([2H])([2H])c1ccc(O)c(OC)c1
MolPort-000-154-542 0.80 CC(=O)c1ccc(O)c(O)c1
MolPort-001-770-650 0.80 CC(=O)c1cccc(Oc2ccccc2)c1
MolPort-011-912-341 0.80 COc1cccc(c1)C(=O)c1cccc(OC)c1
MolPort-000-144-466 0.80 COc1ccc(O)c(c1)C(C)=O
MolPort-004-962-526 0.80 COc1ccc(C(C)=O)c(C)c1
MolPort-002-485-158 0.80 COc1ccc(C(C)=O)c2c(O)cccc12
MolPort-022-369-990 0.80 CCc1cc(OC)ccc1C=O
MolPort-026-226-970 0.80 COc1cc(ccc1C)C(C)=O
MolPort-002-501-772 0.80 CCc1ccc(O)c(OC)c1
MCULE-9501549860 0.80 C1(=CC=C(O)C(O)=C1)C(C)=O
MCULE-6493096993 0.80 C1(O)C=CC(CC)=CC=1OC
MCULE-4779047576 0.80 CC(=O)C1C(C)=C(OC)C=CC=1
MCULE-3762428948 0.80 COC1=CC(C(C2=CC(OC)=CC=C2)=O)=CC=C1
MCULE-9745721575 0.80 C1(C=CC=C(OC2C=CC=CC=2)C=1)C(C)=O
MCULE-7719812498 0.80 C1(C=C(OC)C=CC=1O)C(C)=O
MCULE-7426269510 0.80 COC1C=CC(C=O)=C(C(C)C)C=1OC
MCULE-1313585691 0.80 C1(C=CC=C(OC)C=1)C(=O)C1=CC=CC=C1
MCULE-9766826637 0.80 COC1=CC(C)=C(C(C)=O)C=C1
MCULE-4760493361 0.80 C(=O)(C1=CC=C(OCC)C=C1)C1=CC=CC(OC)=C1
MCULE-4565047847 0.80 C(=O)(C1=CC=C(C=C1)OC(C)(C)C)C1=CC=CC(OC)=C1
MCULE-6956507692 0.80 C12C(=CC=CC1=C(OC)C=CC=2C(C)=O)O
MCULE-3892797181 0.79 C1(=CC(OC)=C(C(OC)=C1)OC)C(=O)C1=CC=CC2=CC=CC=C12
MCULE-5656766946 0.79 C1(=CC(OC)=C(C(OC)=C1)OC)C(=O)C1C=CC2=CC(OC)=CC=C2C=1
MCULE-3458921217 0.79 C1(=C(OC)C=C(C(C=O)=O)C=C1OC)OC
MCULE-3924037698 0.79 C1(=CC=C(C(OC)=C1)OC)C(COC)=O
MCULE-8462461725 0.79 C1(=CC=C(OC)C(OC)=C1)C(=O)C(F)F
MCULE-3636860417 0.79 C1(=CC=C(OC)C(OC)=C1)C(C(CC)CC)=O
MCULE-9573919814 0.79 C(Cl)(Cl)(Cl)C(=O)C1=CC=C(OC)C(OC)=C1
MCULE-7555527245 0.79 C(=O)(CC(C)C)C1=CC=C(OC)C(OC)=C1
MCULE-4869212308 0.79 C1(=CC=C(OC)C(OC)=C1)C(C(C)CC)=O
MCULE-4161692744 0.79 C1(C=CC(=C(OC)C=1)OC)C(CCC)=O
MCULE-5837950928 0.79 C1(C(C)=O)=CC=C(C(OC)=C1OC)OC
MCULE-9514156872 0.79 CCC(C1=CC(OC)=C(OC)C(OC)=C1)=O
MCULE-1544100649 0.79 C1(=CC=C(OC)C(OC)=C1)C(=O)C(C)(C)CC
MCULE-3117173868 0.79 COC1=C(OC(F)F)C=CC(C(C)=O)=C1
MCULE-2835983988 0.79 C(=O)(CC(C)(C)C)C1=CC=C(OC)C(OC)=C1
MCULE-6979165918 0.79 CCCOC1=C(OCCC)C=C(C(C)=O)C=C1
MCULE-5368470257 0.79 COC1=C(OC)C=C(C(C(F)(F)F)=O)C=C1
MCULE-3188109530 0.79 C1(C(OC)=CC=C(C(C)=O)C=1)OCC(C)C
MCULE-1202068347 0.79 C1(OC)=CC(=CC=C1OC)C=O
MCULE-8481721606 0.79 COC1=CC(C(C(C)(C)C)=O)=CC=C1
MCULE-3684930994 0.79 C1=C(OC)C=C(C=C1)C(C=O)=O
MCULE-9115959678 0.79 C(=O)(C1=CC=CC(OC)=C1)C1C=CC2=CC(OC)=CC=C2C=1
MCULE-7998865765 0.79 C1(C(C)=O)=CC(OC)=CC(C(C)=O)=C1
MCULE-1778064620 0.79 C(=O)(C1=CC=CC(OC)=C1)C1=CC=CC2=CC=CC=C12
MCULE-2024754674 0.79 C(C(C)C)(=O)C1C=CC=C(OC)C=1
MCULE-7878655997 0.79 CCC(C1=CC(OC)=CC=C1)=O
MCULE-1570220566 0.79 C(C)(=O)C1C=CC(=CC=1)OC
MCULE-7242978140 0.79 C(=O)(C1=CC=C(C=C1)OC1=CC=CC=C1)C1=CC=CC(OC)=C1
MCULE-8578720412 0.79 C1(=CC(OC)=CC(OC)=C1)C(=O)C1=CC=C(C=C1)OC
MolPort-006-127-707 0.79 CCC(=O)c1cccc(OC)c1
MolPort-033-437-684 0.79 COc1ccc(cc1OC)C(=O)C(F)F
MolPort-003-738-149 0.79 COc1ccc(cc1)C(=O)c1cc(OC)cc(OC)c1
MolPort-000-831-720 0.79 COc1ccc(cc1)C(C)=O
MolPort-002-834-814 0.79 COCC(=O)c1ccc(OC)c(OC)c1
MolPort-002-911-058 0.79 CCCC(=O)c1ccc(OC)c(OC)c1
MolPort-008-549-213 0.79 COc1ccc(cc1OC)C(=O)CC(C)C
MolPort-001-768-703 0.79 COc1ccc(C(C)=O)c(OC)c1OC
MolPort-008-609-354 0.79 CCC(=O)c1cc(OC)c(OC)c(OC)c1
MolPort-001-757-354 0.79 O.COc1cccc(c1)C(=O)C=O
MolPort-046-682-261 0.79 COc1cc(cc(c1)C(C)=O)C(C)=O
MolPort-002-466-122 0.79 CCCOc1ccc(cc1OCCC)C(C)=O
MolPort-029-808-895 0.79 CCCOc1cc(ccc1OC)C(C)=O
MolPort-027-949-532 0.79 COc1ccc(cc1OC)C(=O)C(Br)Br
MolPort-000-887-520 0.79 COc1cc(ccc1OC(F)F)C(C)=O
MolPort-003-991-334 0.79 O.COc1cc(cc(OC)c1OC)C(=O)C=O
MolPort-000-154-716 0.79 COc1ccc(cc1OC)C(=O)C(F)(F)F
MolPort-000-871-214 0.79 COc1ccc(C=O)cc1OC
MolPort-003-823-671 0.79 COc1cccc(c1)C(=O)C=O
MolPort-008-645-301 0.79 COc1cccc(c1)C(=O)C(C)C
MolPort-008-647-437 0.79 COc1cccc(c1)C(=O)C(C)(C)C
MolPort-006-013-702 0.79 CCC(C)Oc1ccc(cc1OC)C(C)=O
MCULE-3882365516 0.79 COC1C(OC)=CC(C(=O)C(Br)Br)=CC=1
MCULE-2163541960 0.79 CCC(OC1=C(OC)C=C(C(C)=O)C=C1)C
MCULE-9908567344 0.79 C1(=CC=C(OC)C(OC)=C1)C(=O)C(Cl)Cl
MCULE-3847798602 0.79 C1(=CC=C(OC)C(OCCC)=C1)C(C)=O
MCULE-2831917611 0.79 C(=O)(C1=CC=CC=C1C)C1C=CC(=C(OC)C=1)OC
MCULE-3953004058 0.78 C1(C)C=C(OC)C=C(C)C=1C(C)=O
MCULE-2438332479 0.78 CC(=O)C1C=C(OC)C(Br)=CC=1
MCULE-7500181817 0.78 C(C1=CC=C(O)C(OC)=C1)(=O)C(C1=CC=C(O)C(OC)=C1)=O
MCULE-4360389498 0.78 C1(C=CC(=C(OC)C=1)O)C(C(C)O)=O
MCULE-4952094903 0.78 C(=O)(C1C=CC(=C(OC)C=1)OC)C1CC1
MCULE-2837927314 0.78 C(=O)(CC1=CC=C(C=C1)OC)C1=CC=C(C(OC)=C1)OC
MCULE-3327289972 0.78 C(=O)(CC1C=CC=CC=1)C1C=CC(=C(OC)C=1)OC
MCULE-4852040988 0.78 C(C)(C1C(C)=CC2=C(C=1)OCO2)=O
MCULE-5853244364 0.78 C1(O)=C(OC)C=C(C=C1I)C(C)=O
MCULE-1254005135 0.78 C1(C(C)=O)C=C(OC)C(=CC=1F)O
MCULE-6725619229 0.78 COC1=C(OCC#N)C=CC(C(C)=O)=C1
MCULE-9653415188 0.78 C1(=CC=C(C(OC)=C1)OCC)C(CC)=O
MCULE-5990983959 0.78 C1(=CC=C(C(OC)=C1)OC)C(=O)C(C)=O
MCULE-5840319297 0.78 COC1=CC(C(=O)C#C)=CC(OC)=C1OC
MCULE-4302316991 0.78 C1(O)C(OC)=CC(=CC=1O)C=O
MCULE-8003002433 0.78 C1(O)=C(C)C=C(C=C1OC)C=O
MCULE-7064672949 0.78 C1(C)C(C=O)=CC(OC)=C(O)C=1
MolPort-002-805-690 0.78 COc1ccc(CC(=O)c2ccc(OC)c(OC)c2)cc1
MolPort-003-800-432 0.78 COc1cc(C)c(C(C)=O)c(C)c1
MolPort-000-830-224 0.78 COc1ccc(cc1OC)C(=O)C(C)=O
MolPort-004-341-140 0.78 COc1cc(ccc1OCC#N)C(C)=O
MolPort-002-747-746 0.78 COc1ccc(cc1OC)C(=O)C1CC1
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MolPort-001-813-095 0.68 Cc1ccc(cc1)C(=O)c1ccc(Oc2ccc(C)c(C)c2)cc1
MCULE-5573726306 0.68 C1(OC)C=C(CC=C)C=CC=1OCCOC1=CC=C(C=C1OCC)C=O
MolPort-002-466-850 0.68 COc1cc(ccc1OCC1CO1)C(C)=O
MCULE-6234828950 0.68 C1(C(C)=O)=CC(OC)=C(C=C1Br)OCC
MolPort-008-609-324 0.68 CCCC(=O)c1cccc(OCC)c1
MCULE-8730998082 0.68 C(=CN(C)C)C(=O)C1C=CC(OC)=C(OC)C=1
MolPort-002-714-622 0.68 CCN(CC)CCC(=O)c1ccc(OC)c(OC)c1
MCULE-7667086623 0.68 N(=O)(=O)CC(=O)C1C=C(OC)C(=C(OC)C=1)OC
MolPort-002-121-342 0.68 CCC(=O)c1ccc(OCc2ccccc2)c(OC)c1
MCULE-1875103362 0.68 C(F)(F)(Br)C(=O)C1=CC=C(OC)C(OC)=C1
MolPort-002-875-434 0.68