Vitas-M small molecule compound
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-(4-methoxyphenyl)-N-[2-(morpholin-4-yl)ethyl]propanamide
Catalog ID
STL551886
SMILES COc1ccc(cc1)C(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)CC(=O)NCCN1CCOCC1
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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 C34H44N2O8 MW 608.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H44N2O8/c1-23-7-6-10-26(37)9-5-3-4-8-25-21-29(38)32(33(40)31(25)34(41)44-23)28(24-11-13-27(42-2)14-12-24)22-30(39)35-15-16-36-17-19-43-20-18-36/h4,8,11-14,21,23,28,38,40H,3,5-7,9-10,15-20,22H2,1-2H3,(H,35,39)/b8-4+/t23-,28?/m0/s1InChIKey
JPOJRWFIXXNEBL-HNQXJCHPSA-NSynonyms
135640216
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)3(4methoxyphenyl)N(2(morpholin4yl)ethyl)propanamide
3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)3(4methoxyphenyl)~(N)(2morpholin4ylethyl)propanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)3(4methoxyphenyl)N(2morpholinoethyl)propanamide
COc1ccc(cc1)C(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)CC(=O)NCCN1CCOCC1
InChI=1SC34H44N2O8c123761026(37)95348252129(38)32(33(40)31(25)34(41)4423)28(24111327(422)141224)2230(39)35151636171943201836h4811142123283840H357910152022H212H3(H3539)b84+t2328?m0s1
ZINC001547206337
ZINC001547206339
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.