podorhizol beta-D-glucoside
Molecular Formula:
C28H34O13
InChI: InChI=1/C28H34O13/c1-34-18-8-14(9-19(35-2)26(18)36-3)25(41-28-24(32)23(31)22(30)20(10-29)40-28)21-15(11-37-27(21)33)6-13-4-5-16-17(7-13)39-12-38-16/h4-5,7-9,15,20-25,28-32H,6,10-12H2,1-3H3/t15-,20+,21-,22+,23-,24+,25+,28-/m0/s1
InChIKey: InChIKey=IETDTZKBVWFSKR-XYEVPOBGBY
SMILES: [H][C@]1([C@H](COC1=O)Cc2ccc3OCOc3c2)[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c5cc(OC)c(OC)c(OC)c5
Names:
C10876
Podorhizol beta-D-glucoside
podorhizol beta-D-glucoside
(3S,4S)-4-(benzo[1,3]dioxol-5-ylmethyl)-3-[(S)-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-(3,4,5-trimethoxyphenyl)methyl]oxolan-2-one
17187-73-4
Registries:
PubChem CID 443015
ChEBI 27901
Kegg C10876
PubChem ID 13059
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