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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]-N-[(1S)-1-phenylethyl]-3-(3,4,5-trimethoxyphenyl)propanamide

Catalog ID
STL552153
SMILES COc1cc(cc(c1OC)OC)C(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)CC(=O)N[C@H](c1ccccc1)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 C38H45NO9 MW 659.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H45NO9/c1-23-13-12-18-28(40)17-11-7-10-16-26-19-30(41)35(36(43)34(26)38(44)48-23)29(22-33(42)39-24(2)25-14-8-6-9-15-25)27-20-31(45-3)37(47-5)32(21-27)46-4/h6,8-10,14-16,19-21,23-24,29,41,43H,7,11-13,17-18,22H2,1-5H3,(H,39,42)/b16-10+/t23-,24-,
InChIKey
CTPHUKPCPSKUNO-AQDWVJKQSA-N
Synonyms

135640435
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)N((1S)1phenylethyl)3(345trimethoxyphenyl)propanamide
3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)~(N)((1~(S))1phenylethyl)3(345trimethoxyphenyl)propanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)N((S)1phenylethyl)3(345trimethoxyphenyl)propanamide
COc1cc(cc(c1OC)OC)C(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)CC(=O)N(C@H)(c1ccccc1)C
InChI=1SC38H45NO9c12313121828(40)171171016261930(41)35(36(43)34(26)38(44)4823)29(2233(42)3924(2)25148691525)272031(453)37(475)32(2127)464h6810141619212324294143H71113171822H215H3(H3942)b1610+t232429?m0s1
ZINC001547138239
ZINC001547138240

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Available files

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