Vitas-M small molecule compound

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

Catalog ID
STL531803
SMILES CCc1ccc2c(c1)[C@]1(C(=O)N2)N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccccc1

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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 C30H27N3O3 MW 477.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N3O3/c1-2-18-14-15-23-21(17-18)30(28(36)32-23)29(20-11-6-7-12-22(20)31-27(29)35)25(24-13-8-16-33(24)30)26(34)19-9-4-3-5-10-19/h3-7,9-12,14-15,17,24-25H,2,8,13,16H2,1H3,(H,31,35)(H,32,36)/t24-,25-,29+,30+/m0/s1
InChIKey
JMPQHVQAAMURDP-DARZMLDPSA-N
Synonyms
957000-12-3
(1S3R3S7aS)1benzoyl5ethyl11225677aoctahydro1Hdispiro(indole32pyrrolizine33indole)22dione
(1S3R3S7aS)5ethyl1(phenylcarbonyl)5677atetrahydro1Hdispiro(indole32pyrrolizine33indole)22(1H1H)dione
16404476
4methyl9(1234tetrahydronaphthalen1yl)810dihydropyrano(23f)(13)benzoxazin2one
957000123
CCc1ccc2c(c1)(C@)1(C(=O)N2)N2CCC(C@H)2(C@H)((C@@)21C(=O)Nc1c2cccc1)C(=O)c1ccccc1
InChI=1SC22H21NO3c1141121(24)262216(14)9102018(22)1223(132520)1984615523717(15)19h235791119H4681213H21H3
MFCD06767204
ZINC000061999353
ZINC61999353

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Available files

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