Vitas-M small molecule compound
(8S,8aR,11aS)-8-[(3,4-dimethoxyphenyl)carbonyl]-10-(naphthalen-2-yl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STL011386
SMILES COc1ccc(cc1OC)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)cccc2)cccc3
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C33H26N2O5 MW 530.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H26N2O5/c1-39-25-14-12-22(18-26(25)40-2)31(36)30-28-27(29-24-10-6-5-8-20(24)15-16-34(29)30)32(37)35(33(28)38)23-13-11-19-7-3-4-9-21(19)17-23/h3-18,27-30H,1-2H3/t27-,28+,29?,30-/m0/s1InChIKey
WRJGTZQLRHEKEY-KKPBEDLQSA-NSynonyms
1014104-00-7(8S8aR11aS)8((34dimethoxyphenyl)carbonyl)10(naphthalen2yl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS)8(34dimethoxybenzoyl)10(naphthalen2yl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
1014104007
COC1=C(C=C(C=C1)C(=O)C2C3C(C4N2C=CC5=CC=CC=C45)C(=O)N(C3=O)C6=CC7=CC=CC=C7C=C6)OC
COc1ccc(cc1OC)C(=O)(C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc2c(c1)cccc2)cccc3
InChI=1SC33H26N2O5c13925141222(1826(25)402)31(36)302827(29241065820(24)151634(29)30)32(37)35(33(28)38)23131119734921(19)1723h3182730H12H3t2728+29?30m0s1
MFCD18247284
ZINC000101090738
ZINC000101090739
Check stock
See real-time availability and sample size for STL011386 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.