Vitas-M small molecule compound

(1'S,3R,3'S,7a'S)-7''-chloro-1'-[(2,4-dimethoxyphenyl)carbonyl]-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione

Catalog ID
STL531053
SMILES COc1ccc(c(c1)OC)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1Cl

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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 C30H26ClN3O5 MW 544.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26ClN3O5/c1-38-16-12-13-17(23(15-16)39-2)26(35)24-22-11-6-14-34(22)30(19-8-5-9-20(31)25(19)33-28(30)37)29(24)18-7-3-4-10-21(18)32-27(29)36/h3-5,7-10,12-13,15,22,24H,6,11,14H2,1-2H3,(H,32,36)(H,33,37)/t22-,24-,29+,30+/m0/s1
InChIKey
KNDDKRUBELVLKA-SFYJVUIZSA-N
Synonyms
956967-62-7
(1S3R3S7aS)7chloro1((24dimethoxyphenyl)carbonyl)11225677aoctahydro1Hdispiro(indole32pyrrolizine33indole)22dione
(1S3R3S7aS)7chloro1((24dimethoxyphenyl)carbonyl)5677atetrahydro1Hdispiro(indole32pyrrolizine33indole)22(1H1H)dione
(2~(S))2(((2~(S))2(((3~(R))22dimethyl5oxo39~(b)dihydro(13)thiazolo(23a)isoindole3carbonyl)amino)4methylpentanoyl)amino)3methylpentanoicacid
16404658
956967627
COc1ccc(c(c1)OC)C(=O)(C@@H)1(C@@H)2CCCN2(C@@)2((C@)31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1Cl
InChI=1SC25H35N3O5Sc1714(4)18(24(32)33)2720(29)17(1213(2)3)2621(30)1925(56)34231611981015(16)22(31)28(19)23h8111314171923H712H216H3(H2630)(H2729)(H3233)t14?171819+23?m0s1
MFCD06767743
ZINC000070700851
ZINC70700851

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Available files

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