Vitas-M small molecule compound

(2'S,3S,3'S,10b'R)-3'-(phenylcarbonyl)-2'-[(3,4,5-trimethoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one

Catalog ID
STK593942
SMILES COc1cc(cc(c1OC)OC)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 C36H30N2O6 MW 586.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H30N2O6/c1-42-27-19-23(20-28(43-2)33(27)44-3)31(39)29-30(32(40)22-12-5-4-6-13-22)38-18-17-21-11-7-8-14-24(21)34(38)36(29)25-15-9-10-16-26(25)37-35(36)41/h4-20,29-30,34H,1-3H3,(H,37,41)/t29-,30-,34+,36+/m0/s1
InChIKey
FZDYDBZLNGWCSE-AFVNQMBASA-N
Synonyms
1212166-45-4
(1S2S3S10bR)3benzoyl2(345trimethoxybenzoyl)310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)3(phenylcarbonyl)2((345trimethoxyphenyl)carbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)3benzoyl2(345trimethoxybenzoyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1212166454
COC1=CC(=CC(=C1OC)OC)C(=O)C2C(N3C=CC4=CC=CC=C4C3C25C6=CC=CC=C6NC5=O)C(=O)C7=CC=CC=C7
COc1cc(cc(c1OC)OC)C(=O)(C@@H)1(C@@H)(C(=O)c2ccccc2)N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2
InChI=1SC36H30N2O6c142271923(2028(432)33(27)443)31(39)2930(32(40)22125461322)3818172111781424(21)34(38)36(29)25159101626(25)3735(36)41h420293034H13H3(H3741)t293034+36+m0s1
MFCD18158444
ZINC000101672360
ZINC101672360

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Available files

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