Vitas-M small molecule compound
(2'S,3S,3'S,10b'R)-3'-(2,2-dimethylpropanoyl)-2'-(furan-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Catalog ID
STK549982
SMILES O=C([C@@H]1[C@H](N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C)c1ccco1
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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 C29H26N2O4 MW 466.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O4/c1-28(2,3)26(33)23-22(24(32)21-13-8-16-35-21)29(19-11-6-7-12-20(19)30-27(29)34)25-18-10-5-4-9-17(18)14-15-31(23)25/h4-16,22-23,25H,1-3H3,(H,30,34)/t22-,23-,25+,29+/m0/s1InChIKey
PITQDDVAYVXESA-WSQBEXMKSA-NSynonyms
1176613-26-5(1S2S3S10bR)2(furan2carbonyl)3pivaloyl310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)3(22dimethylpropanoyl)2(furan2carbonyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
(2S3S3S10bR)3(22dimethylpropanoyl)2(furan2ylcarbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
1176613265
CC(C)(C)C(=O)C1C(C2(C3N1C=CC4=CC=CC=C34)C5=CC=CC=C5NC2=O)C(=O)C6=CC=CO6
InChI=1SC29H26N2O4c128(23)26(33)2322(24(32)21138163521)29(1911671220(19)3027(29)34)25181054917(18)141531(23)25h416222325H13H3(H3034)t222325+29+m0s1
MFCD18242501
O=C((C@@H)1(C@H)(N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C)c1ccco1
ZINC000049649294
ZINC49649294
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.