3β-[(2-O-β-D-Glucopyranosyl-β-D-glucopyranuronosyl)oxy]oleana-12-ene-28-oicacid
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3β-[(2-O-β-D-Glucopyranosyl-β-D-glucopyranuronosyl)oxy]oleana-12-ene-28-oicacid
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CAS No:
80930-74-1
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Formula:
C42H66O14
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Chemical Name:
3β-[(2-O-β-D-Glucopyranosyl-β-D-glucopyranuronosyl)oxy]oleana-12-ene-28-oicacid
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Synonyms:
Zingibroside R1;28-Deglucosylchikusetsusaponin V;28-O-Deglucosylchikusetsusaponin V;3β-(2-O-β-D-Glucopyranosyl-β-D-glucopyranuronosyloxy)oleana-12-ene-28-oic acid;3β-[(2-O-β-D-Glucopyranosyl-β-D-glucopyranuronosyl)oxy]oleana-12-ene-28-oic acid;28-Hydroxy-28-oxoolean-12-en-3β-yl 2-O-(β-D-glucopyranosyl)-β-D-glucopyranosiduronic acid
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CAS No:
Description
Zingibroside R1 is dammaranae-type triterpenoid saponin, isolated from rhizomes, taproots, and lateral roots of Panax japonicas C. A. Meyer, shows excellent anti-tumor effects as well as anti-angiogenic activity[1].Zingibroside R1 possesses some anti-HIV-1 activity.Zingibroside R1 has inhibitory effects on the 2-deoxy-D-glucose (2-DG) uptake by EAT cells (IC50=91.3 μM)[2].
3β-[(2-O-β-D-Glucopyranosyl-β-D-glucopyranuronosyl)oxy]oleana-12-ene-28-oicacid Basic Attributes
794.96500
794.44500
Computed Properties
Molecular Weight:795.0
XLogP3:4.5
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:7
Exact Mass:794.44525677
Monoisotopic Mass:794.44525677
Topological Polar Surface Area:233
Heavy Atom Count:56
Complexity:1560
Defined Atom Stereocenter Count:18
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
3β-[(2-O-β-D-Glucopyranosyl-β-D-glucopyranuronosyl)oxy]oleana-12-ene-28-oicacid
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