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Aloe-emodin-glucoside

HCID 147295
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Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
29010-56-8
Standard SMILES
O=C1c2cccc(O)c2C(=O)c2c(O)cc(CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc21
InChIKey
ASQHVCDULHERIH-JNHRPPPUSA-N
Molecular formula
C21H20O10
Average molar mass
432.4 g/mol
Monoisotopic mass
432.10564683

Overview

Aloe-emodin-glucoside has been reported in Senna alexandrina with data available.

Names & identifiers

Preferred name
Aloe-emodin-glucoside
IUPAC
1,8-dihydroxy-3-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]anthracene-9,10-dione
English name
Aloeemodin-ω-O-β-D-glucopyranoside
Molecular formula
C21H20O10
Molecular weight
0

Names & synonyms

ALOE-EMODIN-GLUCOSIDE29010-56-81,8-dihydroxy-3-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]anthracene-9,10-dione1,8-dihydroxy-3-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxymethyl)anthracene-9,10-dioneRefChem:107637850488-89-6Aloe-emodin-3-(hydroxymethyl)-O-beta-D-glucopyranosideAloe-emodin-3-(hydroxymethyl)-O-|A-D-glucopyranoside9,10-Anthracenedione, 1,8-dihydroxy-3-(hydroxymethyl)-, mono-beta-D-glucopyranoside1,8-Dihydroxy-3-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)anthracene-9,10-dioneGlucoaloe emodin1,8-Dihydroxy-3-(hydroxymethyl)-9,10-anthracenedione mono-beta-D-glucopyranoside
Show more names
Aloeemodin-ωAloe-emodin-glucosideAloeemodin-ω-O-β-D-glucopyranoside
orb1684777DTXSID20951621Aloe-emodin 3-O-|?-D-glucosideACA48889HY-N5111TN1371AKOS040760263FS-7251

Properties

Computed structural properties

XLogP
0.2
Topological polar surface area
174 Ų
Hydrogen bond donors
6
Hydrogen bond acceptors
10
Rotatable bonds
4
Heavy atoms
31
Formal charge
0
Complexity
685

Physicochemical properties

Melting point
221 · 221-222 °C

Chemistry & industry

Applications

DescriptionAloe-emodin-glucoside is a stimulant-laxative which has been shown to enhance colonic membrane permeability of water-soluble and poorly permeable compounds.

Suppliers15 total

佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
四川省维克奇生物科技有限公司028-81700200 18116577057 · [email protected]
雷丁试剂0510-85629785 18013409632 · [email protected]
曼斯特(成都)生物科技有限公司18011593992 · [email protected]
上海如吉生物科技发展有限公司021-69955236-807 13918189704 · [email protected]
上海跃腾生物技术有限公司021-36031160 13311776681 · [email protected]
上海孚宇生物科技有限公司18672534757 · [email protected]
爱必信(上海)生物科技有限公司13761418683 · [email protected]
雷丁科技0510-85629785 18013409632 · [email protected]
上海莫奇生物科技有限公司13341702378 · [email protected]
湖北萃园生物科技有限公司18162795156 18162795156 · [email protected]
上海研纯生物医药科技有限公司4001-009266 17349750668 · [email protected]

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
29010-56-8、50488-89-6
PubChem CID
147295
DTXSID
DTXSID20951621
Nikkaji
J2.407.889B
TargetMol中国(陶术生物)15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
上海禾午生物科技有限公司021-57886085 17317861055 · [email protected]