ChemicalBook--->CAS DataBase List--->38736-77-5

38736-77-5

38736-77-5 Structure

38736-77-5 Structure
IdentificationBack Directory
[Name]

Epibetulinic acid
[CAS]

38736-77-5
[Synonyms]

Epibetulinicaci
Epibetulinic acid
3-epi-Betulinic acid
alpha-Betulinic acid
3α-Hydroxylup-20(29)-en-28-oic acid
(3alpha)-3-Hydroxy-lup-20(29)-en-28-oic acid
[Molecular Formula]

C30H48O3
[MDL Number]

MFCD09953801
[MOL File]

38736-77-5.mol
[Molecular Weight]

456.7
Chemical PropertiesBack Directory
[Melting point ]

277℃
[Boiling point ]

550.0±33.0 °C(Predicted)
[density ]

1.065
[storage temp. ]

Sealed in dry,2-8°C
[form ]

Solid
[pka]

4.61±0.70(Predicted)
[color ]

White to off-white
[InChIKey]

QGJZLNKBHJESQX-SPTQAKTHNA-N
[SMILES]

[C@@]12(C)CC[C@]3([C@]([H])([C@H](C(C)=C)CC3)[C@@]1([H])CC[C@]1([H])[C@@]3([C@]([H])(C(C)(C)[C@H](CC3)O)CC[C@@]21C)C)C(O)=O |&1:0,4,5,7,13,17,19,20,25,31,r|
Hazard InformationBack Directory
[Chemical Properties]

White crystalline powder, soluble in organic solvents such as methanol, ethanol, DMSO, etc., derived from sour jujube seeds and lotus root node charcoal.
[Uses]

Epibetulinic Acid exhibits a strong anti-HIV activity. Isolated from the stem bark of Dillenia indica Linn. Also, it can be a potent and selective TGR5 agonists with improved cellular efficacy.
[IC 50]

NO: 0.7 μM (IC50); EP2: 0.6 μM (IC50)
Spectrum DetailBack Directory
[Spectrum Detail]

Epibetulinic acid(38736-77-5)1HNMR
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