Vitas-M small molecule compound
diphenylmethyl (1'R,2'S,3R)-2'-[(3,4-dimethoxyphenyl)carbonyl]-2-oxo-1,1',2,2'-tetrahydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinoline]-1'-carboxylate
Catalog ID
STK542725
SMILES COc1cc(ccc1OC)C(=O)[C@@H]1[C@H](C(=O)OC(c2ccccc2)c2ccccc2)N2C([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1
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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 C42H34N2O6 MW 662.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H34N2O6/c1-48-33-23-21-29(25-34(33)49-2)38(45)36-37(40(46)50-39(27-14-5-3-6-15-27)28-16-7-4-8-17-28)44-32-20-12-9-13-26(32)22-24-35(44)42(36)30-18-10-11-19-31(30)43-41(42)47/h3-25,35-37,39H,1-2H3,(H,43,47)/t35?,36-,37+,42+/m0/s1InChIKey
IYERFCUYSKPHJI-GXCVNVQVSA-NSynonyms
(1R2S3R)benzhydryl2(34dimethoxybenzoyl)2oxo23adihydro1Hspiro(indoline33pyrrolo(12a)quinoline)1carboxylate
benzhydryl(1R2S3R)2(34dimethoxybenzoyl)2oxospiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)1carboxylate
COC1=C(C=C(C=C1)C(=O)C2C(N3C(C24C5=CC=CC=C5NC4=O)C=CC6=CC=CC=C63)C(=O)OC(C7=CC=CC=C7)C8=CC=CC=C8)OC
COc1cc(ccc1OC)C(=O)(C@@H)1(C@H)(C(=O)OC(c2ccccc2)c2ccccc2)N2C((C@)31C(=O)Nc1c3cccc1)C=Cc1c2cccc1
diphenylmethyl(1R2S3R)2((34dimethoxyphenyl)carbonyl)2oxo1122tetrahydro3aHspiro(indole33pyrrolo(12a)quinoline)1carboxylate
InChI=1SC42H34N2O6c14833232129(2534(33)492)38(45)3637(40(46)5039(27145361527)28167481728)4432201291326(32)222435(44)42(36)301810111931(30)4341(42)47h325353739H12H3(H4347)t35?3637+42+m0s1
MFCD18242022
ZINC000150424477
ZINC000150424481
Check stock
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Check stock on Vitas-MAvailable files
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