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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-[(3-methyl-1H-pyrazol-4-yl)methyl]propanamide

Catalog ID
STL551925
SMILES COc1ccc(cc1)C(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)CC(=O)NCc1c[nH]nc1C

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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 C33H39N3O7 MW 589.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H39N3O7/c1-20-8-7-11-25(37)10-6-4-5-9-23-16-28(38)31(32(40)30(23)33(41)43-20)27(22-12-14-26(42-3)15-13-22)17-29(39)34-18-24-19-35-36-21(24)2/h5,9,12-16,19-20,27,38,40H,4,6-8,10-11,17-18H2,1-3H3,(H,34,39)(H,35,36)/b9-5+/t20-,27?/m0/s1
InChIKey
HSPZWYDLZOJDMB-PNQGIUEKSA-N
Synonyms

135640246
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)3(4methoxyphenyl)N((3methyl1Hpyrazol4yl)methyl)propanamide
3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)3(4methoxyphenyl)~(N)((5methyl1~(H)pyrazol4yl)methyl)propanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)3(4methoxyphenyl)N((5methyl1Hpyrazol4yl)methyl)propanamide
COc1ccc(cc1)C(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)CC(=O)NCc1cn(nH)c1C
InChI=1SC33H39N3O7c120871125(37)106459231628(38)31(32(40)30(23)33(41)4320)27(22121426(423)151322)1729(39)34182419353621(24)2h5912161920273840H46810111718H213H3(H3439)(H3536)b95+t2027?m0s1
ZINC001547204149
ZINC001547204151

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Available files

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