Vitas-M small molecule compound
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[(3S)-16-methoxy-3-methyl-1,7-dioxo-3,4,5,6,7,8,9,10,11,12-decahydro-1H-2-benzoxacyclotetradecin-14-yl]oxy}acetamide
Catalog ID
STL565667
SMILES COc1cc(OCC(=O)NCCc2ccc(c(c2)OC)OC)cc2c1C(=O)O[C@@H](C)CCCC(=O)CCCCC2
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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 C31H41NO8 MW 555.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H41NO8/c1-21-9-8-12-24(33)11-7-5-6-10-23-18-25(19-28(38-4)30(23)31(35)40-21)39-20-29(34)32-16-15-22-13-14-26(36-2)27(17-22)37-3/h13-14,17-19,21H,5-12,15-16,20H2,1-4H3,(H,32,34)/t21-/m0/s1InChIKey
KWWRUHJDPCAAJZ-NRFANRHFSA-NSynonyms
1212388-46-9(S)N(34dimethoxyphenethyl)2((16methoxy3methyl17dioxo3456789101112decahydro1Hbenzo(c)(1)oxacyclotetradecin14yl)oxy)acetamide
1212388469
16405205
COc1cc(OCC(=O)NCCc2ccc(c(c2)OC)OC)cc2c1C(=O)O(C@@H)(C)CCCC(=O)CCCCC2
InChI=1SC31H41NO8c121981224(33)1175610231825(1928(384)30(23)31(35)4021)392029(34)32161522131426(362)27(1722)373h1314171921H512151620H214H3(H3234)t21m0s1
MFCD32651713
N(2(34dimethoxyphenyl)ethyl)2(((3S)16methoxy3methyl17dioxo3456789101112decahydro1H2benzoxacyclotetradecin14yl)oxy)acetamide
N(2(34dimethoxyphenyl)ethyl)2(((4S)18methoxy4methyl28dioxo3oxabicyclo(1240)octadeca1(14)1517trien16yl)oxy)acetamide
ZINC000070701492
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