Vitas-M small molecule compound
(2S,3R)-3-methyl-2-((2S)-3-methyl-2-((7S)-5-oxo-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indole-7-carboxamido)butanamido)pentanoic acid
Catalog ID
STL531211
SMILES CCC([C@@H](C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1Cc2c(C3N1C(=O)c1c3cccc1)[nH]c1c2cccc1)C
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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 C30H34N4O5 MW 530.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4O5/c1-5-16(4)24(30(38)39)33-28(36)23(15(2)3)32-27(35)22-14-20-17-10-8-9-13-21(17)31-25(20)26-18-11-6-7-12-19(18)29(37)34(22)26/h6-13,15-16,22-24,26,31H,5,14H2,1-4H3,(H,32,35)(H,33,36)(H,38,39)/t16?,22-,23-,24-,26?/m0/s1InChIKey
MCXFLSYAJJLCEY-CIEJDEJLSA-NSynonyms
956817-65-5(2~(S))3methyl2(((2~(S))3methyl2(((11~(S))9oxo1020diazapentacyclo(11700^(210)0^(38)0^(1419))icosa1(13)357141618heptaene11carbonyl)amino)butanoyl)amino)pentanoicacid
(2S3R)3methyl2((2S)3methyl2((7S)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamido)butanamido)pentanoicacid
16403817
956817655
CCC((C@@H)(C(=O)O)NC(=O)(C@H)(C(C)C)NC(=O)(C@@H)1Cc2c(C3N1C(=O)c1c3cccc1)(nH)c1c2cccc1)C
InChI=1SC30H34N4O5c1516(4)24(30(38)39)3328(36)23(15(2)3)3227(35)2214201710891321(17)3125(20)261811671219(18)29(37)34(22)26h613151622242631H514H214H3(H3235)(H3336)(H3839)t16?22232426?m0s1
ZINC000015959506
ZINC000070699457
Check stock
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Check stock on Vitas-MAvailable files
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