Vitas-M small molecule compound

(1'S,3R,3'S,7a'S)-7''-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
STK581221
SMILES O=C([C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1C)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/c1-19-8-6-12-24-28(19)35-31(39)33(24)32(23-11-4-5-13-25(23)34-30(32)38)27(26-14-7-17-36(26)33)29(37)22-16-15-20-9-2-3-10-21(20)18-22/h2-6,8-13,15-16,18,26-27H,7,14,17H2,1H3,(H,34,38)(H,35,39)/t26-,27-,32+,33+/m0/s1
InChIKey
HTVNOZMEKLYJJG-MRPYTORDSA-N
Synonyms

(1S3R3S7aS)7methyl1(naphthalen2ylcarbonyl)5677atetrahydro1Hdispiro(indole32pyrrolizine33indole)22(1H1H)dione
7methyl1((naphthalen2yl)carbonyl)11225677aoctahydro1Hdispiro(indole32pyrrolizine33indole)22dione
CC1=CC=CC2=C1NC(=O)C23C4(C(C5N3CCC5)C(=O)C6=CC7=CC=CC=C7C=C6)C8=CC=CC=C8NC4=O
InChI=1SC33H27N3O3c11986122428(19)3531(39)33(24)32(2311451325(23)3430(32)38)27(261471736(26)33)29(37)221615209231021(20)1822h268131516182627H71417H21H3(H3438)(H3539)t262732+33+m0s1
MFCD18158203
O=C((C@@H)1(C@@H)2CCCN2(C@@)2((C@)31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1C)c1ccc2c(c1)cccc2
O=C(C1C2CCCN2C2(C31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1C)c1ccc2c(c1)cccc2
ZINC000102665728
ZINC102665728

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Available files

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