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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-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide

Catalog ID
STL551958
SMILES COc1ccc(cc1)C(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)CC(=O)NCCc1scc(n1)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 C34H40N2O7S MW 620.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H40N2O7S/c1-21-20-44-30(36-21)16-17-35-29(39)19-27(23-12-14-26(42-3)15-13-23)32-28(38)18-24-9-5-4-6-10-25(37)11-7-8-22(2)43-34(41)31(24)33(32)40/h5,9,12-15,18,20,22,27,38,40H,4,6-8,10-11,16-17,19H2,1-3H3,(H,35,39)/b9-5+/t22-,27?/m0/s1
InChIKey
KUBPIYNTKOKQCJ-SCNJIWGRSA-N
Synonyms

135640277
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)3(4methoxyphenyl)N(2(4methyl13thiazol2yl)ethyl)propanamide
3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)3(4methoxyphenyl)~(N)(2(4methyl13thiazol2yl)ethyl)propanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)3(4methoxyphenyl)N(2(4methylthiazol2yl)ethyl)propanamide
COc1ccc(cc1)C(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)CC(=O)NCCc1scc(n1)C
InChI=1SC34H40N2O7Sc121204430(3621)16173529(39)1927(23121426(423)151323)3228(38)182495461025(37)117822(2)4334(41)31(24)33(32)40h591215182022273840H4681011161719H213H3(H3539)b95+t2227?m0s1
ZINC001772492983
ZINC001772492986

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Available files

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