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11alpha-hydroxyasiatic acid

Go to external page http://purl.obolibrary.org/obo/CHEBI_68380

A pentacyclic triterpenoid that is the 11alpha-hydroxy derivative of asiatic acid. Isolated from the methanolic extract of the leaves of Symplocos lancifolia, it exhibits antibacterial activity.

Term info

Label

11alpha-hydroxyasiatic acid

Synonyms
  • (2alpha,3beta,11alpha)-2,3,11,23-tetrahydroxyurs-12-en-28-oic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
(2alpha,3beta,11alpha)-2,3,11,23-tetrahydroxyurs-12-en-28-oic acid [ IUPAC ]

charge

0

formula

C30H48O6

has obo namespace

chebi_ontology

id

CHEBI:68380

inchi

InChI=1S/C30H48O6/c1-16-7-10-30(25(35)36)12-11-28(5)18(22(30)17(16)2)13-19(32)23-26(3)14-20(33)24(34)27(4,15-31)21(26)8-9-29(23,28)6/h13,16-17,19-24,31-34H,7-12,14-15H2,1-6H3,(H,35,36)/t16-,17+,19-,20-,21-,22+,23-,24+,26+,27+,28-,29-,30+/m1/s1

inchikey

FFPKNVKIBUBHMY-CCEBUSCFSA-N

mass

504.69850

monoisotopicmass

504.34509

smiles

[H][C@@]12CC[C@]3(C)[C@]([H])([C@H](O)C=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