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Hexaacetyl - haploperoside C
SpectraBase Compound ID 1VrrANC638w
InChI InChI=1S/C34H40O19/c1-14-27(45-15(2)35)29(47-17(4)37)31(49-19(6)39)33(44-14)43-13-25-28(46-16(3)36)30(48-18(5)38)32(50-20(7)40)34(53-25)52-24-12-22-21(11-23(24)42-8)9-10-26(41)51-22/h9-12,14,25,27-34H,13H2,1-8H3/t14-,25+,27-,28+,29+,30+,31+,32+,33+,34+/m0/s1
InChIKey SRRSXTUHQTVABO-DNXYHZOYSA-N
Mol Weight 752.7 g/mol
Molecular Formula C34H40O19
Exact Mass 752.216379 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E36misb1ezM
Name Hexaacetyl - haploperoside C
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H40O19
InChI InChI=1S/C34H40O19/c1-14-27(45-15(2)35)29(47-17(4)37)31(49-19(6)39)33(44-14)43-13-25-28(46-16(3)36)30(48-18(5)38)32(50-20(7)40)34(53-25)52-24-12-22-21(11-23(24)42-8)9-10-26(41)51-22/h9-12,14,25,27-34H,13H2,1-8H3/t14-,25+,27-,28+,29+,30+,31+,32+,33+,34+/m0/s1
InChIKey SRRSXTUHQTVABO-DNXYHZOYSA-N
Molecular Weight 752.675 g/mol
SMILES [C@@]1([C@@]([C@](OC(=O)C)([C@](O[C@]1(Oc1cc2OC(=O)C=Cc2cc1OC)[H])(CO[C@]1([C@@]([C@](OC(=O)C)([C@]([C@@](O1)(C)[H])(OC(=O)C)[H])[H])(OC(=O)C)[H])[H])[H])[H])(OC(=O)C)[H])(OC(=O)C)[H]
SPLASH splash10-0i09-0920000000-6558255dde4e3a89da7e
Source of Spectrum X4-21-30-0
Synonyms 6-Methoxy-7-[O-.alpha.-L-rhamnopyranosyl-(1->6)-(2-O-acetyl-.beta.-D-glucopyranosyloxy]-2H-benzopyran-2-one-Hexaacetate Derivative Acetic acid [4,5-diacetyloxy-2-methyl-6-[[3,4,5-triacetyloxy-6-[(6-methoxy-2-oxo-1-benzopyran-7-yl)oxy]-2-oxanyl]methoxy]-3-oxanyl] ester [4,5-diacetyloxy-2-methyl-6-[[3,4,5-triacetyloxy-6-(6-methoxy-2-oxochromen-7-yl)oxyoxan-2-yl]methoxy]oxan-3-yl] acetate [4,5-diacetoxy-2-methyl-6-[[3,4,5-triacetoxy-6-(6-methoxy-2-oxo-chromen-7-yl)oxy-tetrahydropyran-2-yl]methoxy]tetrahydropyran-3-yl] acetate [4,5-diacetyloxy-2-methyl-6-[[3,4,5-triacetyloxy-6-(6-methoxy-2-oxidanylidene-chromen-7-yl)oxy-oxan-2-yl]methoxy]oxan-3-yl] ethanoate
Wiley ID 1585799