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asiatic acid

Go to external page http://purl.obolibrary.org/obo/CHEBI_2873

A pentacyclic triterpenoid that is ursane substituted by a carboxy group at position 28 and hydroxy groups at positions 2, 3 and 23 (the 2alpha,3beta stereoisomer). It is isolated from Symplocos lancifolia and Vateria indica and exhibits anti-angiogenic activity.

Term info

Label

asiatic acid

Synonyms
  • (2alpha,3beta)-2,3,23-trihydroxyurs-12-en-28-oic acid
  • Asiatic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
(2alpha,3beta)-2,3,23-trihydroxyurs-12-en-28-oic acid [ IUPAC ]

charge

0

formula

C30H48O5

has alternative id

CHEBI:68382

has obo namespace

chebi_ontology

id

CHEBI:2873

inchi

InChI=1S/C30H48O5/c1-17-9-12-30(25(34)35)14-13-28(5)19(23(30)18(17)2)7-8-22-26(3)15-20(32)24(33)27(4,16-31)21(26)10-11-29(22,28)6/h7,17-18,20-24,31-33H,8-16H2,1-6H3,(H,34,35)/t17-,18+,20-,21-,22-,23+,24+,26+,27+,28-,29-,30+/m1/s1

inchikey

JXSVIVRDWWRQRT-UYDOISQJSA-N

mass

488.69910

monoisotopicmass

488.35017

smiles

[H][C@@]12CC[C@]3(C)[C@]([H])(CC=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@@]5(CC[C@@]34C)C(O)=O)[C@@]1(C)C[C@@H](O)[C@H](O)[C@@]2(C)CO