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[(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-[2-benzyloxy-1-(benzyloxymethyl)ethoxy]tetrahydropyran-2-yl]methyl acetate
SpectraBase Compound ID KagPND5GKWP
InChI InChI=1S/C31H38O12/c1-20(32)38-19-27-28(39-21(2)33)29(40-22(3)34)30(41-23(4)35)31(43-27)42-26(17-36-15-24-11-7-5-8-12-24)18-37-16-25-13-9-6-10-14-25/h5-14,26-31H,15-19H2,1-4H3/t27-,28-,29+,30-,31-/m1/s1
InChIKey ARWUCJZZOQBIFO-PXPWAULYSA-N
Mol Weight 602.6 g/mol
Molecular Formula C31H38O12
Exact Mass 602.236327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 64D6K2eVPES
Name [(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-[2-benzyloxy-1-(benzyloxymethyl)ethoxy]tetrahydropyran-2-yl]methyl acetate
Alternate Name(s) [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[1,3-bis(phenylmethoxy)propan-2-yloxy]oxan-2-yl]methyl acetate [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[1,3-bis(phenylmethoxy)propan-2-yloxy]oxan-2-yl]methyl ethanoate Acetic acid [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[1,3-bis(phenylmethoxy)propan-2-yloxy]-2-oxanyl]methyl ester
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Formula C31H38O12
InChI InChI=1S/C31H38O12/c1-20(32)38-19-27-28(39-21(2)33)29(40-22(3)34)30(41-23(4)35)31(43-27)42-26(17-36-15-24-11-7-5-8-12-24)18-37-16-25-13-9-6-10-14-25/h5-14,26-31H,15-19H2,1-4H3/t27-,28-,29+,30-,31-/m1/s1
InChIKey ARWUCJZZOQBIFO-PXPWAULYSA-N
Molecular Weight 602.633 g/mol
SMILES [C@@]1([C@]([C@](OC(=O)C)([C@](O[C@]1(OC(COCc1ccccc1)COCc1ccccc1)[H])(COC(=O)C)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H]
SPLASH splash10-0006-9301000000-c3f64f631607e40df0c2
Source of Spectrum SK-24-1657-13
Wiley ID 866241