Vitas-M small molecule compound
(2'S,3R,3'S,7a'S)-2'-[(4-methoxyphenyl)carbonyl]-5'',7''-dimethyl-5',6',7',7a'-tetrahydrodispiro[indole-3,1'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Catalog ID
STL532779
SMILES COc1ccc(cc1)C(=O)[C@@H]1[C@]2(C(=O)Nc3c2cc(C)cc3C)N2[C@H]([C@]31C(=O)Nc1c3cccc1)CCC2
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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 C31H29N3O4 MW 507.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O4/c1-17-15-18(2)25-22(16-17)31(29(37)33-25)27(26(35)19-10-12-20(38-3)13-11-19)30(24-9-6-14-34(24)31)21-7-4-5-8-23(21)32-28(30)36/h4-5,7-8,10-13,15-16,24,27H,6,9,14H2,1-3H3,(H,32,36)(H,33,37)/t24-,27-,30+,31+/m0/s1InChIKey
WTFWXBIQZIGIDT-LQBYHZHOSA-NSynonyms
1176563-70-4(2S3R3S7aS)2((4methoxyphenyl)carbonyl)57dimethyl11225677aoctahydro2Hdispiro(indole31pyrrolizine33indole)22dione
(2S3R3S7aS)2((4methoxyphenyl)carbonyl)57dimethyl5677atetrahydrodispiro(indole31pyrrolizine33indole)22(1H1H)dione
~(N)cyclohexyl4((15~(S))10(4methoxyphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzamide
1176563704
16403293
COc1ccc(cc1)C(=O)(C@@H)1(C@)2(C(=O)Nc3c2cc(C)cc3C)N2(C@H)((C@)31C(=O)Nc1c3cccc1)CCC2
InChI=1SC33H32N4O4c14124171320(141824)302926(259561027(25)3529)192832(39)36(33(40)37(28)30)23151121(121623)31(38)34227324822h5691822283035H247819H21H3(H3438)t2830?m0s1
MFCD06495504
ZINC000035363860
ZINC35363860
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.