Vitas-M small molecule compound
(2'S,3S,3'S,10b'R)-3'-[(3-nitrophenyl)carbonyl]-2'-{[2-(prop-2-en-1-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Catalog ID
STK585842
SMILES C=CCOc1ccccc1C(=O)[C@@H]1[C@@H](C(=O)c2cccc(c2)[N+](=O)[O-])N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2
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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 C36H27N3O6 MW 597.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H27N3O6/c1-2-20-45-29-17-8-5-14-26(29)33(41)30-31(32(40)23-11-9-12-24(21-23)39(43)44)38-19-18-22-10-3-4-13-25(22)34(38)36(30)27-15-6-7-16-28(27)37-35(36)42/h2-19,21,30-31,34H,1,20H2,(H,37,42)/t30-,31-,34+,36+/m0/s1InChIKey
QUHHVEIWASLWJA-UOWMXVQPSA-NSynonyms
1212149-09-1(1S2S3S10bR)2(2(allyloxy)benzoyl)3(3nitrobenzoyl)310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)3((3nitrophenyl)carbonyl)2((2(prop2en1yloxy)phenyl)carbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)3(3nitrobenzoyl)2(2prop2enoxybenzoyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
C=CCOC1=CC=CC=C1C(=O)C2C(N3C=CC4=CC=CC=C4C3C25C6=CC=CC=C6NC5=O)C(=O)C7=CC(=CC=C7)(N+)(=O)(O)
C=CCOc1ccccc1C(=O)(C@@H)1(C@@H)(C(=O)c2cccc(c2)(N+)(=O)(O))N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2
Registry IDs
MFCD18158291ZINC000101318668
ZINC101318668
Check stock
See real-time availability and sample size for STK585842 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.