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-(prop-2-yn-1-yl)propanamide
Catalog ID
STL551842
SMILES C#CCNC(=O)CC(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)c1ccc(cc1)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 C31H35NO7 MW 533.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35NO7/c1-4-17-32-27(35)19-25(21-13-15-24(38-3)16-14-21)29-26(34)18-22-10-6-5-7-11-23(33)12-8-9-20(2)39-31(37)28(22)30(29)36/h1,6,10,13-16,18,20,25,34,36H,5,7-9,11-12,17,19H2,2-3H3,(H,32,35)/b10-6+/t20-,25?/m0/s1InChIKey
DWGGPSSNTWYJPF-PHRVMANWSA-NSynonyms
135640178
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)3(4methoxyphenyl)N(prop2yn1yl)propanamide
3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)3(4methoxyphenyl)~(N)prop2ynylpropanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)3(4methoxyphenyl)N(prop2yn1yl)propanamide
C#CCNC(=O)CC(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)c1ccc(cc1)OC
InChI=1SC31H35NO7c14173227(35)1925(21131524(383)161421)2926(34)1822106571123(33)128920(2)3931(37)28(22)30(29)36h161013161820253436H57911121719H223H3(H3235)b106+t2025?m0s1
ZINC001772492861
ZINC001772492862
Check stock
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Check stock on Vitas-MAvailable files
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