SANC00385 Reticuline




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MolPort-042-682-691 1 COC1=C(O)C=C(C[C@H]2N(C)CCC3=CC(OC)=C(O)C=C23)C=C1
MolPort-039-338-460 1 COC1=C(O)C=C2[C@H](CC3=CC=C(O)C=C3)[N+](C)(C)CCC2=C1
MolPort-046-158-434 1 COC1=C(O)C=C2[C@@H](CC3=CC=C(O)C=C3)N(C)CCC2=C1
MolPort-005-981-212 1 COC1=CC=C(C[C@@H]2N(C)CCC3=C2C=C(O)C(OC)=C3)C=C1O
MCULE-1367303166 1 C1(OC)C=C2CCN(C)[C@]([H])(CC3C=CC(OC)=C(O)C=3)C2=CC=1O
MCULE-4953302730 1 C1(OC)C=C2CCN(C)[C@@]([H])(CC3C=CC(OC)=C(O)C=3)C2=CC=1O
MCULE-3775135762 0.99 C12=CC(=C(O)C=C1CCN(C)C2CC1=CC=C(OC)C(OC)=C1)O
MolPort-046-690-894 0.99 Cl.COC1=C(O)C=C(C[C@@H]2N(C)CCC3=CC(OC)=C(O)C=C23)C=C1
MolPort-046-690-082 0.99 Cl.COC1=C(O)C=C2[C@H](CC3=CC(O)=C(O)C=C3)N(C)CCC2=C1
MolPort-001-728-064 0.99 COC1=CC=C(CC2N(C)CCC3=C2C=C(O)C(O)=C3)C=C1OC
MCULE-1603862294 0.98 C12C=C(OC)C(=CC=1CCN(C)C2CC1C=CC(=CC=1)O)OC
MCULE-5044903349 0.98 [N+]1(C)(C)CCC2=C(C=C(C(OC)=C2)OC)[C@@]1([H])CC1C=CC(=CC=1)[O-]
MCULE-2591645144 0.98 COC1C(OC)=CC2=C(CCN([C@@H]2CC2=CC=C(O)C=C2)C)C=1
MCULE-2724982116 0.98 C12C=C(OC)C(=CC=1CCN(C)C2CC1=CC=C(C(O)=C1)OC)OC
MCULE-1232528834 0.98 [N+]1(C)(C)CCC2=C(C=C(C(OC)=C2)OC)C1([H])CC1=CC=C(O)C=C1
MCULE-7558810534 0.98 [N+]1(C)(C)C(CC2=CC(OC)=C(OC)C=C2)C2=CC(OC)=C(OC)C=C2CC1
MCULE-1703608488 0.98 C1(OC)C=C2C(CC3=CC(OC)=C(OC)C=C3)N(C)CCC2=CC=1OC
MCULE-9824379461 0.98 C12C=C(OC)C(=CC=1CCN(C)[C@H]2CC1=CC=C(C(OC)=C1)OC)OC
MCULE-7667495210 0.98 C12C=C(OC)C(=CC=1CCN(C)[C@]2([H])CC1C=CC(=CC=1)O)OC
MCULE-5295622555 0.98 C1(OC)C=C2CCN[C@@]([H])(CC3C=CC(O)=CC=3)C2=CC=1O
MolPort-001-728-096 0.98 COC1=CC2=C(C=C1OC)C(CC1=CC=C(O)C=C1)N(C)CC2
MolPort-000-881-248 0.98 COC1=CC=C(C[C@H]2N(C)CCC3=C2C=C(OC)C(OC)=C3)C=C1O
MolPort-001-728-151 0.98 COC1=CC=C(CC2N(C)CCC3=C2C=C(OC)C(OC)=C3)C=C1OC
MolPort-001-728-132 0.98 COC1=CC2=C(C=C1OC)[C@@H](CC1=CC=C(O)C=C1)N(C)CC2
MolPort-001-728-116 0.98 COC1=CC=C(C[C@@H]2N(C)CCC3=C2C=C(OC)C(OC)=C3)C=C1OC
MolPort-019-904-720 0.98 COC1=C(O)C=C2[C@H](CC3=CC=C(O)C=C3)NCCC2=C1
MCULE-7716398349 0.97 [I-].[N+]1(C)(C)C(CC2=CC(OC)=C(OC)C=C2)C2=CC(OC)=C(OC)C=C2CC1
MCULE-6943816006 0.97 [N+]1(C)(C)CCC2=C(C=C(C(OC)=C2)OC)[C@@]1([H])CC1C=CC(=CC=1)[O-].I
MCULE-3362777972 0.97 [I-].[N+]1(C)(C)CCC2=C(C=C(C(OC)=C2)OC)C1([H])CC1=CC=C(O)C=C1
MCULE-1195280672 0.97 C12C(CC3C=CC(OC)=CC=3)NCCC1=CC(O)=C(OC)C=2
MolPort-009-758-169 0.97 I.COC1=C(OC)C=C2[C@@H](CC3=CC=C([O-])C=C3)[N+](C)(C)CCC2=C1
MolPort-000-731-845 0.97 [I-].COC1=C(OC)C=C2C(CC3=CC=C(O)C=C3)[N+](C)(C)CCC2=C1
MolPort-046-763-847 0.97 Cl.COC1=C(O)C=C2[C@H](CC3=CC=C(O)C=C3)NCCC2=C1
MolPort-046-763-411 0.97 Cl.COC1=C(O)C=C2[C@H](CC3=CC(O)=C(O)C=C3)NCCC2=C1
MCULE-5732311573 0.96 C12C(CC)N(C)CCC1=CC(OC)=C(O)C=2
MCULE-6211989689 0.96 C1(OC)C=C2CC[N+]3(C)[C@@]([H])(CC4C=C(O)C(OC)=CC=4C3)C2=CC=1O
MCULE-8291298220 0.96 N12CC3=CC(OC)=C(C=C3CC1C1C(CC2)=CC(OC)=C(O)C=1)O
MCULE-2870382656 0.96 C[N@+]12CC3C(=CC(=C(C=3)OC)O)C[C@@]1([H])C1C(=CC(=C(C=1)O)OC)CC2
MolPort-046-594-389 0.96 COC1=C(O)C=C2CC3C4=CC(O)=C(OC)C=C4CC[N+]3(C)CC2=C1
MolPort-023-220-751 0.96 COC1=CC2=C(C[C@H]3C4=CC(O)=C(OC)C=C4CC[N+]3(C)C2)C=C1O
MolPort-002-711-488 0.95 COC1=CC=C(CC2NCCC3=CC(OC)=C(OC)C=C23)C=C1OC
MolPort-005-932-651 0.95 COC1=CC=C(C[C@H]2NCCC3=CC(OC)=C(OC)C=C23)C=C1OC
MolPort-046-158-432 0.95 COC1=C(OC)C=C2[C@H](CC3=CC=C(O)C=C3)NCCC2=C1
MCULE-7429300053 0.95 C12C(CC3C=CC(OC)=CC=3)NCCC1=CC(O)=C(OC)C=2.Cl
MCULE-7127931962 0.95 C12C=C(C(OC)=CC=1CCN[C@@H]2CC1=CC=C(OC)C(OC)=C1)OC
MCULE-4925299859 0.95 C12CCNC(CC3C=CC(OC)=C(OC)C=3)C=1C=C(OC)C(OC)=C2
MCULE-1347832392 0.95 C1(CC2C3=CC(OC)=C(OC)C=C3CCN2)C=CC=CC=1
MCULE-9723343367 0.95 [Cl-].[NH+]1(C)CCC2C(=CC(=C(OC)C=2)O)C1CC
MolPort-027-720-900 0.94 [Cl-].COC1=CC2=C(C=C1O)[C@@H]1CC3=CC(O)=C(OC)C=C3C[N+]1(C)CC2
MolPort-038-384-918 0.94 Cl.COC1=CC=C(C[C@@H]2NCCC3=CC(OC)=C(OC)C=C23)C=C1OC
MolPort-002-500-281 0.94 Cl.COC1=CC=C(C[C@H]2NCCC3=C2C=C(OC)C(OC)=C3)C=C1OC
MolPort-001-770-233 0.94 Cl.COC1=CC=C(CC2NCCC3=C2C=C(OC)C(OC)=C3)C=C1OC
MCULE-1407847664 0.94 [Cl-].C[N@+]12CC3C(=CC(=C(C=3)OC)O)C[C@@]1([H])C1C(=CC(=C(C=1)O)OC)CC2
MCULE-8212608565 0.94 N12CCC3C(=CC(=C(OC)C=3)OC)C1CC1=CC(=C(O)C=C1C2)O
MCULE-9162219244 0.94 N12C(C)C3C=C(OC)C(OC)=CC=3CC1C1C=C(OC)C(OC)=CC=1CC2
MCULE-7120454480 0.94 N12CCC3C(=CC(=C(OC)C=3)OC)C1CC1C=C(OC)C(OC)=CC=1C2
MCULE-7256042540 0.94 [Cl-].C1(OC)C=C2CC[N+]3(C)[C@@]([H])(CC4C=C(O)C(OC)=CC=4C3)C2=CC=1O
MCULE-1200373525 0.94 I.C12C(CCNC1CC1=CC=C(C(OC)=C1)OC)=CC(=C(OC)C=2)OC
MCULE-1856051680 0.94 Cl.C12C=C(C(OC)=CC=1CCN[C@@H]2CC1=CC=C(OC)C(OC)=C1)OC
MCULE-1380409514 0.94 Cl.C12CCNC(CC3C=CC(OC)=C(OC)C=3)C=1C=C(OC)C(OC)=C2
MCULE-1092485874 0.94 Br.C12=C(CCNC1CC1=CC=C(C(OC)=C1)OC)C=C(C(OC)=C2)OC
MCULE-7273307698 0.94 C12C(CC)[NH2+]CCC1=CC(OC)=C(O)C=2
MCULE-5600894184 0.93 Cl.N12C(C)C3C=C(OC)C(OC)=CC=3CC1C1C=C(OC)C(OC)=CC=1CC2
MCULE-9246797226 0.93 COC1C=C(CC2C3C=C(C(=CC=3CCN2C)OC)OC)C=C(OC)C=1OC
MCULE-7463631898 0.93 C12C=C(OC)C(=CC=1CC(NC2CC1C=CC=CC=1)(C)C)OC
MCULE-7643258857 0.93 [Cl-].C12C(CC)[NH2+]CCC1=CC(OC)=C(O)C=2
MCULE-8926372975 0.93 C12C(CC)NCCC1=CC(O)=C(OC)C=2
MolPort-044-560-957 0.92 Cl.COC1=CC2=C(C=C1OC)C(CC1=CC(OC)=C(OC)C(OC)=C1)N(C)CC2
MolPort-044-722-868 0.92 Cl.COC1=CC2=C(C=C1OC)C(CC1=CC=CC=C1)NC(C)(C)C2
MCULE-4071188423 0.92 COC1C=C(CC2C3C=C(C(=CC=3CCN2C)OC)OC)C=C(OC)C=1OC.Cl
MCULE-7327694142 0.92 C1C2C=C(OC)C(OC)=CC=2C2NC1C1C=C(OC)C(OC)=CC=1C2
MCULE-8620597365 0.92 C1(OC)C(OC)=CC2C(CC3C=CC=CC=3)[NH2+]C(C)(C)CC=2C=1.[Cl-]
MCULE-1313997148 0.92 C1(OC)C(OC)=CC2C(NCCC=2C=1)CC
MCULE-5995409132 0.92 Cl.C12C(CC)NCCC1=CC(O)=C(OC)C=2
MCULE-5136750602 0.92 C12=C(CCNC1C(C)C)C=C(C(OC)=C2)OC
MCULE-2750201534 0.92 C12C=CC(=CC=1CCNC2CC1C=CC=CC=1)OC
MolPort-002-348-172 0.92 CCC1NCCC2=CC(OC)=C(OC)C=C12
MolPort-003-733-562 0.92 COC1=C(OC)C=C2C(NCCC2=C1)C(C)C
MolPort-020-005-719 0.91 COC1=CC2=C(C=C1O)[C@@H]1CC3=CC=C(O)C(OC)=C3CN1CC2
MolPort-046-153-752 0.91 COC1=C(O)C=C2[C@@H]3CC4=C(CN3CCC2=C1)C(O)=C(OC)C=C4
MolPort-003-850-289 0.91 COC1=C(O)C=C2C3CC4=C(CN3CCC2=C1)C(OC)=C(O)C=C4
MCULE-5347617329 0.91 OC1C(OC)=CC2CCN3CC4C(=C(C=CC=4C[C@@]3([H])C=2C=1)O)OC
MCULE-1663051633 0.91 [C@@]12([H])CC3=C(C(O)=C(OC)C=C3)CN1CCC1C=C(OC)C(O)=CC2=1
MCULE-6361134516 0.91 C1(OC)C=C2CCN3CC4C(OC)=C(O)C=CC=4C[C@@]3([H])C2=CC=1O
MCULE-6345887730 0.91 [N+]1(C)(CCCC[N+]2(C)CCC3=C(C=C(C(OC)=C3)OC)C2CC2=CC=C(OC)C=C2)CCC2=C(C=C(C(OC)=C2)OC)C1CC1C=CC(OC)=CC=1
MCULE-6852566251 0.91 C1C2C=C(OC)C(OC)=CC=2C2NC1C1C=C(OC)C(OC)=CC=1C2.Cl
MCULE-1404654898 0.91 C1(C)=C(OC)C(OC)=CC2=C1C(CC1C=CC(O)=CC=1)NCC2
MCULE-6845267239 0.91 C1(CC2=CC(OC)=C(OC)C(OC)=C2)C2=C(C=C(OC)C(OC)=C2)CCN1
MCULE-5568998779 0.91 C1(=C(C=C2C(=C1)C(C(C)C)NCC2)OC)OC.Cl
MCULE-6980021409 0.91 Cl.C12C=CC(=CC=1CCNC2CC1C=CC=CC=1)OC
MolPort-004-946-811 0.91 Cl.COC1=CC2=C(C=C1OC)C(NCC2)C(C)C
MolPort-008-440-375 0.91 Cl.COC1=CC2=C(C=C1)C(CC1=CC=CC=C1)NCC2
MolPort-046-594-384 0.90 COC1=C(OC)C=C2C(CC3=CC=C(OC4=C(O)C=CC(CC5N(C)CCC6=CC(OC)=C(OC)C=C56)=C4)C=C3)N(C)CCC2=C1
MolPort-039-052-321 0.90 COC1=CC2=C(C=C1OC)[C@@H](CC1=CC=C(O)C(OC3=CC=C(C[C@H]4N(C)CCC5=CC(OC)=C(OC)C=C45)C=C3)=C1)N(C)CC2
MolPort-000-756-471 0.90 [I-].[I-].COC1=CC=C(CC2C3=CC(OC)=C(OC)C=C3CC[N+]2(C)CCCC[N+]2(C)CCC3=CC(OC)=C(OC)C=C3C2CC2=CC=C(OC)C=C2)C=C1
MolPort-020-005-910 0.90 COC1=CC2=C(CCN(C)[C@@H]2CC2=CC=C(OC3=CC(C[C@H]4N(C)CCC5=C4C=C(OC)C(OC)=C5)=CC=C3O)C=C2)C=C1O
MolPort-020-005-909 0.90 COC1=CC2=C(C=C1O)[C@@H](CC1=CC=C(O)C(OC3=CC=C(C[C@H]4N(C)CCC5=C4C=C(OC)C(OC)=C5)C=C3)=C1)N(C)CC2
MolPort-035-705-715 0.90 COC1=CC=C2CC[N+](C)(C)[C@@H](CC3=CC=C(O)C=C3)C2=C1O
MCULE-5928389662 0.90 CN1C(CC2C=CC(OC3C=C(CC4N(C)CCC5C4=CC(OC)=C(OC)C=5)C=CC=3O)=CC=2)C2C(=CC(OC)=C(OC)C=2)CC1
MCULE-3934803914 0.90 C12C=C(C(OC)=CC=1CCN(C)[C@@H]2CC1C=CC(OC2=C(O)C=CC(C[C@H]3NCCC4C=C(C(OC)=CC3=4)OC)=C2)=CC=1)OC
MCULE-4656622603 0.90 OC1C(OC)=CC2[C@H](N(CCC=2C=1)C)CC1C=C(OC2C=CC(C[C@@H]3C4C=C(C(=CC=4CCN3C)OC)OC)=CC=2)C(O)=CC=1
MCULE-7949916991 0.90 C12CCN(C)[C@]([H])(CC3C=C(OC4C=CC(=CC=4)C[C@@]4([H])N(C)CCC5=CC(OC)=C(OC)C=C54)C(O)=CC=3)C=1C=C(OC)C(OC)=C2
MCULE-7839551618 0.90 [N+]1(C)(CCCC[N+]2(C)CCC3=C(C=C(C(OC)=C3)OC)C2CC2=CC=C(OC)C=C2)CCC2=C(C=C(C(OC)=C2)OC)C1CC1C=CC(OC)=CC=1.[I-].[I-]
MCULE-8356205204 0.90 C12CCN(C)[C@]([H])(CC3C=C(OC4C=CC(=CC=4)C[C@@]4([H])N(C)CCC5=CC(O)=C(OC)C=C54)C(O)=CC=3)C=1C=C(OC)C(OC)=C2
MCULE-9710337094 0.90 C12CCN(C)[C@]([H])(CC3C=C(OC4C=CC(=CC=4)C[C@@]4([H])N(C)CCC5=CC(OC)=C(OC)C=C54)C(O)=CC=3)C=1C=C(O)C(OC)=C2
MCULE-3428081362 0.90 C12=CC(=C(OC)C=C1CCN(C=O)C2CC1=CC=C(O)C(OC)=C1)O
MCULE-4708681685 0.90 C12=CC(=C(OC)C=C1CCN(C)[C@@H]2CC1C=CC(O)=C(OC2C=CC(C[C@@H]3N(C)CCC4C=C(OC)C(OC)=CC3=4)=CC=2)C=1)OC
MCULE-5022763601 0.90 Cl.C1(C)=C(OC)C(OC)=CC2=C1C(CC1C=CC(O)=CC=1)NCC2
MCULE-5420536073 0.90 C1(OC)=C(O)C=C2C(CCN(C)C2CC(C)C)=C1
MCULE-8947407209 0.90 C12C=C(OC)C(=CC=1CC(C)(C)NC2C(C)C)OC
MolPort-039-052-634 0.89 COC1=C(O)C=C2CCN3CC4=C(C[C@H]3C2=C1)C=CC(OC)=C4OC
MolPort-000-881-202 0.89 COC1=CC2=C(C=C1OC)[C@@H]1CC3=C(CN1CC2)C(OC)=C(OC)C=C3
MolPort-046-790-508 0.89 COC1=C(OC)C=C2[C@H]3[C@@H](C)C4=C(CN3CCC2=C1)C(OC)=C(O)C=C4
MolPort-001-728-168 0.89 COC1=CC2=C(C=C1OC)C1C(C)C3=CC=C(OC)C(OC)=C3CN1CC2
MolPort-000-882-010 0.89 COC1=C(O)C=C2CCN3CC4=C(C[C@@H]3C2=C1)C=CC(OC)=C4OC
MolPort-023-332-930 0.89 COC1=CC=C2C[C@@H]3N(CCC4=CC(OC)=C(O)C=C34)CC2=C1OC
MolPort-000-487-312 0.89 COC1=C(OC)C=C2C3CC4=C(CN3CCC2=C1)C(OC)=C(OC)C=C4
MolPort-044-649-467 0.89 COC1=CC2=C(CCN3CC4=C(CC23)C=CC(OC)=C4OC)C=C1O
MolPort-019-996-257 0.89 COC1=CC2=C(C=C1OC)[C@@H]1CC3=C(CN1CC2)C(OC)=C(O)C=C3
MolPort-001-728-092 0.89 COC1=CC2=C(C=C1OC)C(CC1=CC=C(OCOC3=CC=C(CC4N(C)CCC5=C4C=C(OC)C(OC)=C5)C=C3)C=C1)N(C)CC2
MolPort-001-728-103 0.89 COC1=C(OC)C=C2[C@H]3CC4=C(CN3CCC2=C1)C(OC)=C(OC)C=C4
MolPort-039-052-373 0.89 COC1=C(OC)C=C2[C@H]3C(C)C4=C(CN3CCC2=C1)C(OC)=C(OC)C=C4
MolPort-001-728-102 0.89 COC1=C(OC)C=C2C3CC4=C(C[NH+]3CCC2=C1)C(OC)=C(OC)C=C4
MolPort-001-740-784 0.89 COC1=C(OC)C=C2[C@H]3[C@@H](C)C4=C(CN3CCC2=C1)C(OC)=C(OC)C=C4
MolPort-002-821-586 0.89 COC1=C(OC)C=C2C(NCCC2=C1)C(C1=CC=CC=C1)C1=CC=C(C)C=C1
MolPort-002-464-738 0.89 CCOC1=CC=C(CC2NCCC3=CC(OCC)=C(OCC)C=C23)C=C1OCC
MCULE-9823434055 0.89 N12CCC3C(=CC(=C(OC)C=3)OC)[C@]1([H])CC1=CC=C(OC)C(OC)=C1C2
MCULE-5827277495 0.89 C1(OC)C=C2CCN3CC4C(OC)=C(O)C=CC=4C[C@@]3([H])C2=CC=1OC
MCULE-9943627177 0.89 C1(O)C=C2CCN3CC4C(OC)=C(OC)C=CC=4C[C@@]3([H])C2=CC=1OC
MCULE-8349247867 0.89 [N+]12(C)CCC3=C(C=C(C(OC)=C3)OC)C1CC1=CC=C(OC)C(OC)=C1C2
MCULE-2739186472 0.89 C1(OC)C=C2CCN3CC4C(OC)=C(OC)C=CC=4C[C@@]3([H])C2=CC=1O
MCULE-1328768112 0.89 N12CCC3C(=CC(=C(OC)C=3)OC)[C@@]1([H])CC1C=CC(OC)=C(OC)C=1C2
MCULE-2017822931 0.89 C12C=C(O)C(=CC=1CCN(C)C2CC1C=CC(=C(O)C=1)O)O
MCULE-4908172299 0.89 C12C(CCNC1CC1C=CC(=C(OCC)C=1)OCC)=CC(=C(OCC)C=2)OCC
MCULE-7447617521 0.89 C1(OC)C(OC)=CC2C(C(C)C)[NH2+]C(C)(C)CC=2C=1.[Cl-]
MCULE-8053846682 0.89 N1(CCC2=C(C=C(C(OC)=C2)OC)C1)C(C)CC1=CC=C(C(OC)=C1)O
MCULE-9406913648 0.89 COC1C=C2C(C(N(CC2)C)CC2C=CC(O)=C(OC3C=C4C(CCN(C4CC4C=CC(O)=CC=4)C)=CC=3OC)C=2)=CC=1OC
MCULE-5545107428 0.89 C12C=C(C(OC)=CC=1CCN(C)[C@@H]2CC1=CC=C(O)C=C1)OC1=C(O)C=CC(C[C@H]2N(C)CCC3C=C(OC)C(OC)=CC2=3)=C1
MCULE-6225386441 0.89 C12C=C(C(OC)=CC=1CCN(C)[C@@H]2CC1=CC=C(O)C=C1)OC1=C(O)C=CC(C[C@H]2N(C)CCC3C=C(C(OC)=CC2=3)OC)=C1
MCULE-5517747794 0.89 [C@H]1(CC2=CC(=C(O)C=C2)OC2C(=CC3=C(C=2)[C@H](N(CC3)C)CC2=CC=C(OC)C=C2)OC)N(C)CCC2C=C(OC)C(O)=CC1=2
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