Vitas-M small molecule compound
2'-[(3,4-dimethoxyphenyl)carbonyl]-1'-(2,2-dimethylpropanoyl)-5',7'-dimethyl-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STL052525
SMILES COc1ccc(cc1OC)C(=O)C1C(N2C(C31C(=O)Nc1c3cccc1)C=C(c1c2ccc(c1)C)C)C(=O)C(C)(C)C
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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 C35H36N2O5 MW 564.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H36N2O5/c1-19-12-14-25-22(16-19)20(2)17-28-35(23-10-8-9-11-24(23)36-33(35)40)29(30(37(25)28)32(39)34(3,4)5)31(38)21-13-15-26(41-6)27(18-21)42-7/h8-18,28-30H,1-7H3,(H,36,40)InChIKey
KCTHGZUOXIIMGF-UHFFFAOYSA-NSynonyms
(1S2S3R3aR)2(34dimethoxybenzoyl)57dimethyl1pivaloyl23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
2((34dimethoxyphenyl)carbonyl)1(22dimethylpropanoyl)57dimethyl12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
2(34dimethoxybenzoyl)1(22dimethylpropanoyl)57dimethylspiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
CC1=CC2=C(C=C1)N3C(C=C2C)C4(C(C3C(=O)C(C)(C)C)C(=O)C5=CC(=C(C=C5)OC)OC)C6=CC=CC=C6NC4=O
COc1ccc(cc1OC)C(=O)(C@@H)1(C@H)(N2(C@@H)((C@)31C(=O)Nc1c3cccc1)C=C(c1c2ccc(c1)C)C)C(=O)C(C)(C)C
InChI=1SC35H36N2O5c11912142522(1619)20(2)172835(2310891124(23)3633(35)40)29(30(37(25)28)32(39)34(34)5)31(38)21131526(416)27(1821)427h8182830H17H3(H3640)
MFCD05727148
ZINC000106019099
ZINC000245246389
Check stock
See real-time availability and sample size for STL052525 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.