Vitas-M small molecule compound
N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-L-alanyl-L-isoleucine
Catalog ID
STL544538
SMILES CC[C@H]([C@@H](C(=O)O)NC(=O)[C@@H](Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C)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 C30H39N3O8 MW 569.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H39N3O8/c1-8-15(2)26(30(37)38)33-29(36)16(3)31-22-12-10-19-20(14-23(22)35)21(32-17(4)34)11-9-18-13-24(39-5)27(40-6)28(41-7)25(18)19/h10,12-16,21,26H,8-9,11H2,1-7H3,(H,31,35)(H,32,34)(H,33,36)(H,37,38)/t15-,16+,21+,26+/m1/s1InChIKey
XAIMRQJRAHWSLF-BIJPZOJXSA-NSynonyms
(2~(S)3~(R))2(((2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)propanoyl)amino)3methylpentanoicacid
(2S3R)2((S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)propanamido)3methylpentanoicacid
110207161
CC(C@H)((C@@H)(C(=O)O)NC(=O)(C@@H)(Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C)C
InChI=1SC30H39N3O8c1815(2)26(30(37)38)3329(36)16(3)312212101920(1423(22)35)21(3217(4)34)119181324(395)27(406)28(417)25(18)19h1012162126H8911H217H3(H3135)(H3234)(H3336)(H3738)t1516+21+26+m1s1
N((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)LalanylLisoleucine
ZINC000253414302
ZINC253414302
Check stock
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Check stock on Vitas-MAvailable files
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