Vitas-M small molecule compound
(2'S,3S,3'S,10b'R)-3'-(phenylcarbonyl)-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
STK588692
SMILES C=CCOc1ccccc1C(=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/c1-2-22-42-29-19-11-8-16-26(29)33(40)30-31(32(39)24-13-4-3-5-14-24)38-21-20-23-12-6-7-15-25(23)34(38)36(30)27-17-9-10-18-28(27)37-35(36)41/h2-21,30-31,34H,1,22H2,(H,37,41)/t30-,31-,34+,36+/m0/s1InChIKey
AWQGCAORDVFYKY-UOWMXVQPSA-NSynonyms
1212419-18-5(1S2S3S10bR)2(2(allyloxy)benzoyl)3benzoyl310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)3(phenylcarbonyl)2((2(prop2en1yloxy)phenyl)carbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)3benzoyl2(2prop2enoxybenzoyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1212419185
C=CCOC1=CC=CC=C1C(=O)C2C(N3C=CC4=CC=CC=C4C3C25C6=CC=CC=C6NC5=O)C(=O)C7=CC=CC=C7
C=CCOc1ccccc1C(=O)(C@@H)1(C@@H)(C(=O)c2ccccc2)N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2
InChI=1SC36H28N2O4c12224229191181626(29)33(40)3031(32(39)24134351424)3821202312671525(23)34(38)36(30)27179101828(27)3735(36)41h221303134H122H2(H3741)t303134+36+m0s1
MFCD18158344
ZINC000101318683
ZINC101318683
Check stock
See real-time availability and sample size for STK588692 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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