Vitas-M small molecule compound
(2'S,3S,3'S,10b'R)-3'-(phenylcarbonyl)-2'-{[3-(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
STK599216
SMILES C=CCOc1cccc(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2)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 C36H28N2O4 MW 552.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H28N2O4/c1-2-21-42-26-15-10-14-25(22-26)32(39)30-31(33(40)24-12-4-3-5-13-24)38-20-19-23-11-6-7-16-27(23)34(38)36(30)28-17-8-9-18-29(28)37-35(36)41/h2-20,22,30-31,34H,1,21H2,(H,37,41)/t30-,31-,34+,36+/m0/s1InChIKey
BXSMBCRZTGURLG-UOWMXVQPSA-NSynonyms
1212138-53-8(1S2S3S10bR)2(3(allyloxy)benzoyl)3benzoyl310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)3(phenylcarbonyl)2((3(prop2en1yloxy)phenyl)carbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)3benzoyl2(3prop2enoxybenzoyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1212138538
C=CCOC1=CC=CC(=C1)C(=O)C2C(N3C=CC4=CC=CC=C4C3C25C6=CC=CC=C6NC5=O)C(=O)C7=CC=CC=C7
C=CCOc1cccc(c1)C(=O)(C@@H)1(C@@H)(C(=O)c2ccccc2)N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2
InChI=1SC36H28N2O4c1221422615101425(2226)32(39)3031(33(40)24124351324)3820192311671627(23)34(38)36(30)2817891829(28)3735(36)41h22022303134H121H2(H3741)t303134+36+m0s1
MFCD18158566
ZINC000101312908
ZINC101312908
Check stock
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Check stock on Vitas-MAvailable files
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