Vitas-M small molecule compound
N-(cyanomethyl)-3-[(3S,11E)-14,16-dihydroxy-3-methyl-1,7-dioxo-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecin-15-yl]-3-(3,4,5-trimethoxyphenyl)propanamide
Catalog ID
STL552262
SMILES N#CCNC(=O)CC(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)c1cc(OC)c(c(c1)OC)OC
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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 C32H38N2O9 MW 594.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H38N2O9/c1-19-9-8-12-22(35)11-7-5-6-10-20-15-24(36)29(30(38)28(20)32(39)43-19)23(18-27(37)34-14-13-33)21-16-25(40-2)31(42-4)26(17-21)41-3/h6,10,15-17,19,23,36,38H,5,7-9,11-12,14,18H2,1-4H3,(H,34,37)/b10-6+/t19-,23?/m0/s1InChIKey
GUXUQABZUVLHFP-NZORKGKJSA-NSynonyms
~(N)(cyanomethyl)3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)3(345trimethoxyphenyl)propanamide
135640527
InChI=1SC32H38N2O9c119981222(35)1175610201524(36)29(30(38)28(20)32(39)4319)23(1827(37)34141333)211625(402)31(424)26(1721)413h610151719233638H57911121418H214H3(H3437)b106+t1923?m0s1
N#CCNC(=O)CC(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)c1cc(OC)c(c(c1)OC)OC
N(cyanomethyl)3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)3(345trimethoxyphenyl)propanamide
N(cyanomethyl)3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)3(345trimethoxyphenyl)propanamide
ZINC001547138785
ZINC001547138786
Check stock
See real-time availability and sample size for STL552262 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.