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Germanasim E
SpectraBase Compound ID KHlAfMBGJel
InChI InChI=1S/C29H32O16/c1-38-27-18-14(6-15-26(27)42-10-41-15)39-8-13(19(18)31)11-2-4-12(5-3-11)43-29-25(37)23(35)21(33)17(45-29)9-40-28-24(36)22(34)20(32)16(7-30)44-28/h2-6,8,16-17,20-25,28-30,32-37H,7,9-10H2,1H3/t16-,17+,20-,21+,22+,23-,24-,25+,28-,29+/m1/s1
InChIKey FIMKKXUVGBDUNE-NXDDTDBWSA-N
Mol Weight 636.6 g/mol
Molecular Formula C29H32O16
Exact Mass 636.169035 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVSD4BbZxNe
Name Germanasim E
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H32O16
InChI InChI=1S/C29H32O16/c1-38-27-18-14(6-15-26(27)42-10-41-15)39-8-13(19(18)31)11-2-4-12(5-3-11)43-29-25(37)23(35)21(33)17(45-29)9-40-28-24(36)22(34)20(32)16(7-30)44-28/h2-6,8,16-17,20-25,28-30,32-37H,7,9-10H2,1H3/t16-,17+,20-,21+,22+,23-,24-,25+,28-,29+/m1/s1
InChIKey FIMKKXUVGBDUNE-NXDDTDBWSA-N
Molecular Weight 636.559 g/mol
SMILES O[C@@]1([C@]([C@](CO[C@]2([C@@]([C@]([C@@]([C@@](CO)(O2)[H])(O)[H])(O)[H])(O)[H])[H])(O[C@@]([C@]1(O)[H])(Oc1ccc(C=2C(c3c(c4OCOc4cc3OC2)OC)=O)cc1)[H])[H])(O)[H])[H]
SPLASH splash10-03dj-0349000000-cccceb5cb3bd2a53ce8e
Source of Spectrum H-86-3361-3
Synonyms 7-{4'-[O-.beta.-D-Glucopyranosyl-(1->6)-.beta.-D-glucopyranosyl)ox]phenyl}-9-methoxy-8H-1,3-dioxolo[4,5-g]-(1)-benzopyran-8-one 9-Methoxy-7-[4-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-2-oxanyl]oxy]phenyl]-[1,3]dioxolo[4,5-g][1]benzopyran-8-one 9-Methoxy-7-[4-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyphenyl]-[1,3]dioxolo[4,5-g]chromen-8-one 9-Methoxy-7-[4-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxyphenyl]-[1,3]dioxolo[4,5-g]chromen-8-one 7-[4-[6-[[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxyphenyl]-9-methoxy-[1,3]dioxolo[4,5-g]chromen-8-one
Wiley ID 1525714