Vitas-M small molecule compound

(1'S,3R,3'S,7a'S)-1'-[(3-methoxyphenyl)carbonyl]-7''-methyl-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione

Catalog ID
STL533464
SMILES COc1cccc(c1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1C

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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 C30H27N3O4 MW 493.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N3O4/c1-17-8-5-12-21-25(17)32-28(36)30(21)29(20-11-3-4-13-22(20)31-27(29)35)24(23-14-7-15-33(23)30)26(34)18-9-6-10-19(16-18)37-2/h3-6,8-13,16,23-24H,7,14-15H2,1-2H3,(H,31,35)(H,32,36)/t23-,24-,29+,30+/m0/s1
InChIKey
GFPWAQIHWBGSEM-BAAZAXTHSA-N
Synonyms
956948-49-5
(1S3R3S7aS)1((3methoxyphenyl)carbonyl)7methyl11225677aoctahydro1Hdispiro(indole32pyrrolizine33indole)22dione
(1S3R3S7aS)1((3methoxyphenyl)carbonyl)7methyl5677atetrahydro1Hdispiro(indole32pyrrolizine33indole)22(1H1H)dione
~(N)(3butoxypropyl)2((15~(S))10(3chlorophenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzamide
16404838
956948495
COc1cccc(c1)C(=O)(C@@H)1(C@@H)2CCCN2(C@@)2((C@)31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1C
InChI=1SC33H33ClN4O4c1231742189163531(39)2413571527(24)3832(40)2820252312461426(23)3629(25)30(37(28)33(38)41)211081122(34)1921h48101519283036H239161820H21H3(H3539)t2830?m0s1
MFCD06768225
ZINC000061999420
ZINC61999420

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.