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(3R,4S,5S,6R,8R)-10-Dimethoxyphosphono-3,5-isopropylidenedioxy-4-methoxy-6-[2-(4-methoxybenzyloxy)ethyl]-8-methyl-9-oxodecanoic acid

View entire compound with spectra: 1 MS (GC)

(3R,4S,5S,6R,8R)-10-Dimethoxyphosphono-3,5-isopropylidenedioxy-4-methoxy-6-[2-(4-methoxybenzyloxy)ethyl]-8-methyl-9-oxodecanoic acid
SpectraBase Compound ID 2gVIEL9rGhJ
InChI InChI=1S/C27H43O11P/c1-18(22(28)17-39(31,34-6)35-7)14-20(12-13-36-16-19-8-10-21(32-4)11-9-19)25-26(33-5)23(15-24(29)30)37-27(2,3)38-25/h8-11,18,20,23,25-26H,12-17H2,1-7H3,(H,29,30)/t18-,20+,23-,25+,26+/m1/s1
InChIKey KMRWJMFDADCKQE-LFKNALSDSA-N
Mol Weight 574.6 g/mol
Molecular Formula C27H43O11P
Exact Mass 574.254299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EuRbto3SDxs
Name (3R,4S,5S,6R,8R)-10-Dimethoxyphosphono-3,5-isopropylidenedioxy-4-methoxy-6-[2-(4-methoxybenzyloxy)ethyl]-8-methyl-9-oxodecanoic acid
Alternate Name(s) 2,6,7-trideoxy-6-[(2R)-4-(dimethoxyphosphoryl)-2-methyl-3-oxobutyl]-8-O-(4-methoxybenzyl)-4-O-methyl-3,5-O-(1-methylethylidene)-D-ido-octonic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H43O11P
InChI InChI=1S/C27H43O11P/c1-18(22(28)17-39(31,34-6)35-7)14-20(12-13-36-16-19-8-10-21(32-4)11-9-19)25-26(33-5)23(15-24(29)30)37-27(2,3)38-25/h8-11,18,20,23,25-26H,12-17H2,1-7H3,(H,29,30)/t18-,20+,23-,25+,26+/m1/s1
InChIKey KMRWJMFDADCKQE-LFKNALSDSA-N
Molecular Weight 574.604 g/mol
SMILES OC(C[C@@]1([C@@]([C@]([C@](C[C@](C(CP(=O)(OC)OC)=O)(C)[H])(CCOCc2ccc(cc2)OC)[H])(OC(O1)(C)C)[H])(OC)[H])[H])=O
SPLASH splash10-00di-0900000000-2bd6078cb5a2c22aeb17
Source of Spectrum E1-39-71-8
Wiley ID 1518628