Vitas-M small molecule compound

(1'S,3R,3'S,7a'S)-1'-{[3-(prop-2-en-1-yloxy)phenyl]carbonyl}-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione

Catalog ID
STL529682
SMILES C=CCOc1cccc(c1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1

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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 C31H27N3O4 MW 505.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N3O4/c1-2-17-38-20-10-7-9-19(18-20)27(35)26-25-15-8-16-34(25)31(22-12-4-6-14-24(22)33-29(31)37)30(26)21-11-3-5-13-23(21)32-28(30)36/h2-7,9-14,18,25-26H,1,8,15-17H2,(H,32,36)(H,33,37)/t25-,26-,30+,31+/m0/s1
InChIKey
NHTZQXFLDCOHMO-GLKSXAEWSA-N
Synonyms
956936-81-5
(1S3R3S7aS)1((3(prop2en1yloxy)phenyl)carbonyl)11225677aoctahydro1Hdispiro(indole32pyrrolizine33indole)22dione
(1S3R3S7aS)1((3(prop2en1yloxy)phenyl)carbonyl)5677atetrahydro1Hdispiro(indole32pyrrolizine33indole)22(1H1H)dione
16404258
2(2((8chloro4oxo23dihydro1~(H)cyclopenta(c)chromen7yl)oxy)propanoylamino)3(5hydroxy1~(H)indol3yl)propanoicacid
2(2((8CHLORO4OXO23DIHYDRO1HCYCLOPENTA(C)CHROMEN7YL)OXY)PROPANOYLAMINO)3(5HYDROXY1HINDOL3YL)PROPANOICACID
956936815
C=CCOc1cccc(c1)C(=O)(C@@H)1(C@@H)2CCCN2(C@@)2((C@)31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1
InChI=1SC26H23ClN2O7c112(3523102218(919(23)27)1532416(15)26(34)3622)24(31)2921(25(32)33)7131128206514(30)817(13)20h56812212830H247H21H3(H2931)(H3233)
MFCD06766606
ZINC000059485896
ZINC59485896

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Available files

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