Vitas-M small molecule compound
N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(2-hydroxyethyl)-L-isoleucinamide
Catalog ID
STL543169
SMILES OCCNC(=O)[C@H]([C@@H](CC)C)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)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 C29H39N3O7 MW 541.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H39N3O7/c1-7-16(2)26(29(36)30-12-13-33)32-22-11-9-19-20(15-23(22)35)21(31-17(3)34)10-8-18-14-24(37-4)27(38-5)28(39-6)25(18)19/h9,11,14-16,21,26,33H,7-8,10,12-13H2,1-6H3,(H,30,36)(H,31,34)(H,32,35)/t16-,21+,26+/m1/s1InChIKey
KSASMRXTRGMKEE-LVARUYSCSA-NSynonyms
(2~(S)3~(R))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2hydroxyethyl)3methylpentanamide
(2S3R)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2hydroxyethyl)3methylpentanamide
110207638
InChI=1SC29H39N3O7c1716(2)26(29(36)30121333)32221191920(1523(22)35)21(3117(3)34)108181424(374)27(385)28(396)25(18)19h9111416212633H78101213H216H3(H3036)(H3134)(H3235)t1621+26+m1s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2hydroxyethyl)Lisoleucinamide
OCCNC(=O)(C@H)((C@@H)(CC)C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
ZINC000253408430
ZINC253408430
Check stock
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Check stock on Vitas-MAvailable files
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