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CHEBI:149955 - Betulonic acid

ChEBI IDCHEBI:149955
ChEBI NameBetulonic acid
Stars
DownloadsMolfile
FormulaC30H46O3
Net Charge0
Average Mass454.695
Monoisotopic Mass454.34470
SMILES[H][C@]12CC[C@@]3([H])[C@@](C)(CC[C@@]4(C(=O)O)CC[C@@H](C(=C)C)[C@@]43[H])[C@]1(C)CC[C@@]1([H])C(C)(C)C(=O)CC[C@]21C
InChIInChI=1S/C30H46O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-22,24H,1,8-17H2,2-7H3,(H,32,33)/t19-,20+,21-,22+,24+,27-,28+,29+,30-/m0/s1
InChIKeySLJTWDNVZKIDAU-SVAFSPIFSA-N
Roles Classification
Biological Role:
anticoronaviral agent  Any antiviral agent which inhibits the activity of coronaviruses.
ChEBI Ontology
Outgoing Relation(s)
Betulonic acid (CHEBI:149955) has role anticoronaviral agent (CHEBI:149553)
Betulonic acid (CHEBI:149955) is a triterpenoid (CHEBI:36615)
Registry NumbersSources
CAS:4481-62-3ChemIDplus