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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-hexadecyl-3-(4-methoxyphenyl)propanamide

Catalog ID
STL551743
SMILES CCCCCCCCCCCCCCCCNC(=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 C44H65NO7 MW 720.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C44H65NO7/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-30-45-40(48)32-38(34-26-28-37(51-3)29-27-34)42-39(47)31-35-23-18-17-19-24-36(46)25-21-22-33(2)52-44(50)41(35)43(42)49/h18,23,26-29,31,33,38,47,49H,4-17,19-22,24-25,30,32H2,1-3H3,(H,45,48)/b23-18+/t
InChIKey
PRPZFHSTWJUIBQ-FETVDMCSSA-N
Synonyms

135640096
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)Nhexadecyl3(4methoxyphenyl)propanamide
3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)~(N)hexadecyl3(4methoxyphenyl)propanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)Nhexadecyl3(4methoxyphenyl)propanamide
CCCCCCCCCCCCCCCCNC(=O)CC(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)c1ccc(cc1)OC
InChI=1SC44H65NO7c14567891011121314151620304540(48)3238(34262837(513)292734)4239(47)3135231817192436(46)25212233(2)5244(50)41(35)43(42)49h182326293133384749H417192224253032H213H3(H4548)b2318+t3338?m0s1
ZINC001547208857
ZINC001547208858

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

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