SANC00352 Kraussianone 6




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MCULE-6667636668 0.87 C12OC(C)(C)C=CC1=C1OC=C(C3C=CC(O)=CC=3O)C(=O)C1=C(O)C=2CC(O)C(O)(C)C
MolPort-038-386-091 0.87 CC(C)(O)C(O)CC1=C2OC(C)(C)C=CC2=C2OC=C(C(=O)C2=C1O)C1=C(O)C=C(O)C=C1
MolPort-038-386-096 0.83 CC(=C)C(O)CC1=C2OC(C)(C)C=CC2=C2OC=C(C(=O)C2=C1O)C1=C(O)C=C(O)C=C1
MCULE-4536287471 0.83 C12OC(C)(C)C=CC1=C1OC=C(C3C=CC(O)=CC=3O)C(=O)C1=C(O)C=2CC(O)C(C)=C
MolPort-001-913-434 0.82 CC1(C)CCC2=C3OC(C)(C)C=CC3=C3OC=C(C(=O)C3=C2O1)C1=CC=C(O)C=C1
MCULE-9883206898 0.82 C12C3OC(C)(C)CCC=3C3=C(C=CC(C)(C)O3)C=1OC=C(C1=CC=C(C=C1)O)C2=O
MolPort-046-158-408 0.79 CC1(C)OC2=CC=C(C(O)=C2C=C1)C1=COC2=CC(O)=CC(O)=C2C1=O
MCULE-4906359601 0.79 CC1(C)OC2C=CC(C3C(=O)C4C=CC(O)=CC=4OC=3)=C(O)C=2C=C1
MolPort-046-156-413 0.79 CC1(C)OC2=C(C=C1)C(O)=C(C=C2)C1=COC2=CC(O)=CC=C2C1=O
MolPort-019-937-414 0.76 CC1(C)OC2=C(C=C1)C(O)=C1C(=O)C(=COC1=C2)C1=C(O)C=C(O)C=C1
MolPort-005-945-444 0.76 CC(C)=CCC1=C2OC(C)(C)C=CC2=C2OC=C(C(=O)C2=C1O)C1=C(O)C=C(O)C=C1
MCULE-6081905892 0.76 C12OC(C)(C)C=CC=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3O)=COC1=C2
MCULE-5983659423 0.76 C1(=C2OC(C)(C)C=CC2=C2OC=C(C3C=CC(=CC=3O)O)C(=O)C2=C1O)C/C=C(/C)\C
MCULE-1669110017 0.76 C1(O)C=C2OC=C(C3C=C4C=CC(C)(C)OC4=CC=3)C(=O)C2=C(O)C=1C/C=C(\C)/C
MolPort-046-761-011 0.76 CC1(C)OC2=C(C=C1)C(O)=CC=C2C1=COC2=CC(O)=CC(O)=C2C1=O
MolPort-039-338-260 0.76 CC(C)=CCC1=C(O)C=C2OC=C(C(=O)C2=C1O)C1=CC=C2OC(C)(C)C=CC2=C1
MCULE-4403418176 0.75 C12OC(C)(CO)C=CC=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2
MolPort-035-705-993 0.75 CC1(CO)OC2=C(C=C1)C(O)=C1C(=O)C(=COC1=C2)C1=CC=C(O)C=C1
MolPort-039-338-543 0.74 CC1(C)OC2=CC=C(C=C2C=C1)C1=COC2=CC(O)=CC(O)=C2C1=O
MCULE-9710764172 0.74 C1(O)C=C2OC=C(C3C=C4C=CC(C)(C)OC4=CC=3)C(=O)C2=C(O)C=1
MolPort-001-742-714 0.74 CC1(CO)OC2=CC(O)=C3C(=O)C(=COC3=C2C=C1)C1=CC=C(O)C=C1
MolPort-028-599-888 0.73 CC1(C)OC2=C(C=C1)C=C(C=C2)C1=COC2=CC(O)=CC=C2C1=O
MCULE-5058484967 0.73 C1(O)C=C2OC=C(C3C=C4C=CC(C)(C)OC4=CC=3)C(=O)C2=CC=1
MCULE-3018809144 0.73 C1(C2C(=O)C3C(=CC4OC(C)(C)C=CC=4C=3O)OC=2)=CC=C(O)C=C1
MCULE-7599859422 0.73 C12OC(C)(C)C=CC=1C(O)=C1C(=O)C(C3C(O)=CC(O)=CC=3)=COC1=C2C/C=C(\C)/C
MCULE-2006868290 0.73 C12C(O)=C(C/C=C(/C)\C)C3=C(C=CC(C)(C)O3)C=1OC=C(C1=CC=C(C=C1)O)C2=O
MolPort-003-804-185 0.73 CC1(C)OC2=C(C=C1)C(O)=C1C(=O)C(=COC1=C2)C1=CC=C(O)C=C1
MolPort-001-741-965 0.73 CC(C)=CCC1=C2OC(C)(C)C=CC2=C2OC=C(C(=O)C2=C1O)C1=CC=C(O)C=C1
MolPort-039-052-681 0.72 CC1(C)OC2=CC(O)=C3C(=O)C(=COC3=C2C=C1)C1=CC=C(O)C=C1
MCULE-7071226808 0.72 C12OC(C)(C)C=CC1=C1OC=C(C3C=CC(O)=CC=3)C(=O)C1=C(O)C=2
MCULE-5256697366 0.72 CC(=O)OC1C=CC(C2C(=O)C3C(=C4C(=CC=3OC=2)OC(C)(C)C=C4)O)=CC=1
MolPort-035-683-208 0.72 CC(=O)OC1=CC=C(C=C1)C1=COC2=CC3=C(C=CC(C)(C)O3)C(O)=C2C1=O
MCULE-7853104874 0.71 C12OC(C)(C)C=CC=1C=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2
MolPort-039-338-842 0.71 CC1(C)OC2=C(C=C1)C=C1C(=O)C(=COC1=C2)C1=CC=C(O)C=C1
MolPort-042-624-484 0.70 CC1(C)OC2=C(O)C=C(C=C2C=C1)C1=COC2=CC(O)=CC(O)=C2C1=O
MolPort-003-665-850 0.70 CC(C)=CCC1=C2OC(C)(C)C=CC2=C2OC=C(C(=O)C2=C1O)C1=CC(O)=C(O)C=C1
MCULE-1107301039 0.70 C1(O)C=C2OC=C(C3C=C4C=CC(C)(C)OC4=C(O)C=3)C(=O)C2=C(O)C=1
MCULE-3476922697 0.70 C1(=C2OC(C)(C)C=CC2=C2OC=C(C3C=CC(=C(O)C=3)O)C(=O)C2=C1O)C/C=C(/C)\C
MCULE-9553896038 0.70 C12OC(C)(C)C=CC=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2C/C=C(/C)\C
MolPort-019-997-410 0.70 CC(C)=CCC1=C2OC=C(C(=O)C2=C(O)C2=C1OC(C)(C)C=C2)C1=CC=C(O)C=C1
MolPort-027-718-501 0.69 COC1=CC=C(C=C1)C1=COC2=C3C(CC(=O)OC3=CC(O)=C2C1=O)C1=CC2=CC=CC=C2OC1
MCULE-9479599755 0.69 C12C(O)=CC3=C(C(CC(=O)O3)C3COC4=C(C=CC=C4)C=3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MCULE-4036011682 0.69 O1C2=CC(=C3C(C(=COC3=C2C=CC1(C)C)C1C=C(C(=CC=1OC)OC)OC)=O)O
MCULE-1158432248 0.69 C12OC(C(O)(C)C)CC=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2
MCULE-2735023400 0.69 C12OC(C)(C)C=CC=1C=C1C(=O)C(C3C(OC)=CC(OC)=C(OC)C=3)=COC1=C2
MCULE-1354257102 0.69 C12C(O)=CC3=C(C(CC(=O)O3)C3COC4=C(C=CC=C4)C=3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-044-181-349 0.69 COC1=CC(OC)=C(C=C1OC)C1=COC2=C3C=CC(C)(C)OC3=CC(O)=C2C1=O
MolPort-035-705-992 0.69 CC(C)(O)C1CC2=C(O1)C=C1OC=C(C(=O)C1=C2O)C1=CC=C(O)C=C1
MolPort-035-705-990 0.69 COC1=CC(OC)=C(OC)C=C1C1=COC2=CC3=C(C=CC(C)(C)O3)C=C2C1=O
MolPort-028-856-185 0.69 OC1=CC=C(C=C1)C1=COC2=C3C(CC(=O)OC3=CC(O)=C2C1=O)C1=CC2=CC=CC=C2OC1
MolPort-035-705-997 0.68 CC1(C)CCC2=C(O1)C=C1OC=C(C(=O)C1=C2O)C1=CC=C(O)C=C1
MolPort-027-717-974 0.68 COC1=CC=C(C=C1)C1=COC2=C3C(CC(=O)OC3=CC(OC)=C2C1=O)C1=CC2=CC=CC=C2OC1
MolPort-028-856-125 0.68 CC1OC2=CC=CC=C2C=C1C1CC(=O)OC2=CC(O)=C3C(=O)C(=COC3=C12)C1=CC=C(O)C=C1
MolPort-035-705-998 0.68 CC1(C)CCC2=C(O)C=C3OC=C(C(=O)C3=C2O1)C1=CC=C(O)C=C1
MCULE-9774749633 0.68 C12OC(C)(C)CCC=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2
MCULE-3410507284 0.68 C12C(OC)=CC3=C(C(CC(=O)O3)C3COC4=C(C=CC=C4)C=3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MCULE-1751943720 0.68 C1(O)C=C2OC=C(C3C=CC(O)=CC=3)C(=O)C2=C2OC(C)(C)CCC=12
MCULE-5851590379 0.68 C12C(O)=CC3=C(C(CC(=O)O3)C3C(C)OC4=C(C=CC=C4)C=3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-005-945-602 0.67 CC(C)=CCC1=C2OC=C(C(=O)C2=C(O)C2=C1OC(C)(C)C=C2)C1=CC=C(O)C(O)=C1
MCULE-9698046612 0.67 OC1C(O)=CC(C2=COC3C(C2=O)=C(C2C=CC(C)(C)OC=2C=3C/C=C(\C)/C)O)=CC=1
MCULE-4983502522 0.67 C1=CC2=C(C(C/C=C(/C)\C)=C3OC(=O)C(C4C=CC(O)=CC=4)=C(O)C3=C2OC)OC1(C)C
MolPort-039-057-692 0.66 O=C1CC(C2=CC3=CC=CC=C3OC2)C2=C3OC=C(C(=O)C3=CC=C2O1)C1=CC=CC=C1
MolPort-000-424-885 0.66 CCC1=C(OC\C=C\C2=CC=CC=C2)C=C2OC=C(C(=O)C2=C1)C1=CC2=C(OCCO2)C=C1
MolPort-039-056-678 0.66 OC1=C2C(=O)C(=COC2=C2C(CC(=O)OC2=C1)C1=CC2=CC=CC=C2OC1)C1=CC=C(Cl)C=C1
MCULE-3720141746 0.66 C12OC=C(C(=O)C1=CC=C1OC(CC(C3COC4=C(C=CC=C4)C=3)C=21)=O)C1C=CC=CC=1
MCULE-7133606865 0.66 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC=CC3C=CC=CC=3)C=2)CC)C1=O
MCULE-8435892896 0.66 C12C(O)=CC3=C(C(CC(=O)O3)C3COC4=C(C=CC=C4)C=3)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MCULE-6930369995 0.66 C12O[C@H](C(O)(C)C)[C@@H](O)C=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2
MCULE-9897221152 0.66 C12C(O)=CC3=C(C(CC(=O)O3)C3COC4=C(C=CC=C4)C=3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-039-142-019 0.66 CC(C)(O)[C@H]1OC2=C([C@@H]1O)C(O)=C1C(OC=C(C3=CC=C(O)C=C3)C1=O)=C2
MolPort-039-195-357 0.66 COC1=C(OC)C=C(C=C1)C1=COC2=C3C(CC(=O)OC3=CC(O)=C2C1=O)C1=CC2=CC=CC=C2OC1
MCULE-7440039211 0.65 O=C1C(C2C=C3OCOC3=CC=2OC)=COC2C1=CC=C1OC(C)(C)C=CC1=2
MCULE-9740213223 0.65 C1(C2=CC=C(OC)C=C2)C(=O)OC2C(=C(OC)C3=C(OC(CC3)(C)C)C=2)C=1O
MCULE-2443299456 0.65 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OCC=CC3C=CC=CC=3)C=2)C1=O
MolPort-000-425-153 0.65 COC1=C(C=CC=C1)C1=COC2=CC(OC\C=C\C3=CC=CC=C3)=CC=C2C1=O
MolPort-039-338-848 0.65 CC1(C)CCC2=CC(=CC=C2O1)C1=COC2=CC(O)=CC=C2C1=O
MolPort-028-854-821 0.64 COC1=CC=C(C=C1)C1=COC2=C3C(CC(=O)OC3=CC(O)=C2C1=O)C1=CC=C(OCC(C)=C)C=C1
MolPort-039-056-876 0.64 FC1=CC=C(C=C1)C1=COC2=C3C(CC(=O)OC3=CC=C2C1=O)C1=CC2=CC=CC=C2OC1
MolPort-001-742-693 0.64 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OCC3(C)OC4=C(C=C3)C(O)=C3C(=O)C(=COC3=C4)C3=CC=C(O)C=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
MCULE-2185072336 0.64 C1(O)C=C2OC=C(C3C=C4CCC(C)(C)OC4=CC=3)C(=O)C2=CC=1
MCULE-6114132196 0.64 C12C(O)=CC3=C(C(C4C=CC(=CC=4)OCC(C)=C)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MCULE-5342900764 0.64 C12OC=C(C(=O)C=1C=CC1OC(CC(C3COC4=C(C=CC=C4)C=3)C2=1)=O)C1C=CC(=CC=1)F
MCULE-1068638417 0.64 OC1=CC=C(C2=COC3=CC4OC(C)(CO[C@@H]5O[C@H](CO[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)[C@@H](O)[C@H](O)[C@H]5O)C=CC=4C(=C3C2=O)O)C=C1
MCULE-2320957502 0.64 C12O[C@H](C(O)(C)C)[C@@H](OC)C=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2
MolPort-039-338-417 0.64 CO[C@@H]1[C@H](OC2=C1C(O)=C1C(OC=C(C1=O)C1=CC=C(O)C=C1)=C2)C(C)(C)O
MolPort-039-141-993 0.63 CC(C)=CCC1=C2OC=C(C(=O)C2=C(O)C2=C1OC(C2)C(C)(C)O)C1=CC(O)=C(O)C=C1
MolPort-039-052-395 0.63 CC(C)(O)CCC1=C(OC2=C3C=CC(C)(C)OC3=CC(O)=C2C1=O)C1=CC=C(O)C=C1O
MCULE-1107338486 0.63 C12OC(C(O)(C)C)CC=1C(O)=C1C(=O)C(C3C=C(O)C(O)=CC=3)=COC1=C2C/C=C(\C)/C
MCULE-4163909795 0.63 C12=C(OC)C3C=CC(C)(C)OC=3C(C/C=C(/C)\C)=C1OC(=O)C(C1C=CC(=CC=1)O)=C2OC(C)=O
MCULE-9600420350 0.63 C12OC(C)(C)C=CC1=C1OC(C3C(O)=CC(O)=CC=3)=C(CCC(O)(C)C)C(=O)C1=C(O)C=2
MCULE-3358442738 0.63 C12=CC(OC)=C3C(C=CC(C)(C)O3)=C1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MCULE-1767342950 0.63 C12C(O)=CC3=C(C(CC(C)C)CC(=O)O3)C=1OC=C(C1=CC=CC=C1OC)C2=O
MCULE-8182143303 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=CC=3OCC(C)=C)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MCULE-5293175257 0.63 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=C(C=C3)OCC(C)=C)C=21)=O)C1=CC=C(C=C1)O
MCULE-6724003124 0.63 C12C(OC)=CC3=C(C(CC(=O)O3)C3C=CC=CC=3OCC(C)=C)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MCULE-1911979431 0.63 C12C(O)=CC3=C(C(C4C=CC(=CC=4)OC)CC(=O)O3)C=1OC=C(C1=CC=CC=C1OC)C2=O
MolPort-023-274-353 0.63 COC1=C(OC)C=C(C=C1)C1=COC2=C3C=CC(C)(C)OC3=C(OC)C=C2C1=O
MolPort-044-180-265 0.63 COC1=C(C=CC=C1)C1=COC2=C3C(CC(C)C)CC(=O)OC3=CC(O)=C2C1=O
MolPort-028-855-719 0.63 CC(=C)COC1=C(C=CC=C1)C1CC(=O)OC2=CC(O)=C3C(=O)C(=COC3=C12)C1=CC=C(O)C=C1
MolPort-029-885-498 0.63 CC(=C)COC1=CC=C(C=C1)C1CC(=O)OC2=CC=C3C(=O)C(=COC3=C12)C1=CC=C(O)C=C1
MolPort-028-856-249 0.63 COC1=CC=C(C=C1)C1=COC2=C3C(CC(=O)OC3=CC(OC)=C2C1=O)C1=C(OCC(C)=C)C=CC=C1
MolPort-044-179-290 0.63 COC1=CC=C(C=C1)C1CC(=O)OC2=CC(O)=C3C(=O)C(=COC3=C12)C1=C(OC)C=CC=C1
MolPort-044-754-129 0.62 CC(C)(O)C1CC2=C(OC3=C4C=CC(C)(C)OC4=CC(O)=C3C2=O)C2=C(O1)C=C(O)C=C2
MolPort-027-718-486 0.62 COC1=CC=C(C=C1)C1=COC2=C3C(CC(=O)OC3=CC(O)=C2C1=O)C(C)C
MolPort-044-180-358 0.62 COC(=O)COC1=CC=C(C=C1)C1CC(=O)OC2=CC(O)=C3C(=O)C(=COC3=C12)C1=C(OC)C=CC=C1
MolPort-027-718-249 0.62 COC1=CC=C(CCOC2=CC=C(C=C2)C2CC(=O)OC3=CC(O)=C4C(=O)C(=COC4=C23)C2=CC=C(OC)C=C2)C=C1
MolPort-044-179-720 0.62 COC1=CC=C(CCOC2=CC=C(C=C2)C2CC(=O)OC3=CC(O)=C4C(=O)C(=COC4=C23)C2=CC=CC=C2)C=C1
MolPort-000-424-883 0.62 CCC1=C(OC\C=C\C2=CC=CC=C2)C=C2OC(C)=C(C(=O)C2=C1)C1=CC2=C(OCCO2)C=C1
MolPort-044-179-632 0.62 COC1=C(C=CC=C1)C1=COC2=C3C(CC(=O)OC3=CC(O)=C2C1=O)C1=CC=C(O)C=C1
MCULE-8048418677 0.62 C12OC(C)(C)C=CC1=C1OC3C4C=CC(O)=CC=4OC(C(O)(C)C)CC=3C(=O)C1=C(O)C=2
MCULE-7271133087 0.62 C12C(O)=CC3=C(C(C(C)C)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MCULE-1109224964 0.62 C12C(O)=CC3=C(C(C4=CC=C(C=C4)OCC(OC)=O)CC(=O)O3)C=1OC=C(C1=CC=CC=C1OC)C2=O
MCULE-9359456797 0.62 C12C(O)=CC3=C(C(C4=CC=C(C=C4)OCCC4=CC=C(C=C4)OC)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MCULE-8495680852 0.62 C12C(O)=CC3=C(C(C4C=CC(=CC=4)OCCC4C=CC(=CC=4)OC)CC(=O)O3)C=1OC=C(C1=CC=CC=C1)C2=O
MCULE-6316078357 0.62 C12C(O)=CC3=C(C(C4C=CC(=CC=4)O)CC(=O)O3)C=1OC=C(C1=CC=CC=C1OC)C2=O
MCULE-9030975799 0.62 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2C(=CC(=C(OCC=CC3C=CC=CC=3)C=2)CC)C1=O
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