Vitas-M small molecule compound

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

Catalog ID
STK589403
SMILES Cc1ccc2c(c1)[C@]1(C(=O)N2)N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc2c(c1)cccc2

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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 C33H27N3O3 MW 513.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H27N3O3/c1-19-12-15-26-24(17-19)33(31(39)35-26)32(23-9-4-5-10-25(23)34-30(32)38)28(27-11-6-16-36(27)33)29(37)22-14-13-20-7-2-3-8-21(20)18-22/h2-5,7-10,12-15,17-18,27-28H,6,11,16H2,1H3,(H,34,38)(H,35,39)/t27-,28-,32+,33+/m0/s1
InChIKey
LMNHSJQJTVBJIC-RQGZQSEYSA-N
Synonyms

(1S3R3S7aS)5methyl1(naphthalen2ylcarbonyl)5677atetrahydro1Hdispiro(indole32pyrrolizine33indole)22(1H1H)dione
5methyl1((naphthalen2yl)carbonyl)11225677aoctahydro1Hdispiro(indole32pyrrolizine33indole)22dione
CC1=CC2=C(C=C1)NC(=O)C23C4(C(C5N3CCC5)C(=O)C6=CC7=CC=CC=C7C=C6)C8=CC=CC=C8NC4=O
Cc1ccc2c(c1)(C@)1(C(=O)N2)N2CCC(C@H)2(C@H)((C@@)21C(=O)Nc1c2cccc1)C(=O)c1ccc2c(c1)cccc2
Cc1ccc2c(c1)C1(C(=O)N2)N2CCCC2C(C21C(=O)Nc1c2cccc1)C(=O)c1ccc2c(c1)cccc2
InChI=1SC33H27N3O3c11912152624(1719)33(31(39)3526)32(239451025(23)3430(32)38)28(271161636(27)33)29(37)22141320723821(20)1822h25710121517182728H61116H21H3(H3438)(H3539)t272832+33+m0s1
MFCD18158359
ZINC000102673868
ZINC102673868

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Available files

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