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CHEBI:66531 - suberosol

Default Structure
ChEBI IDCHEBI:66531
ChEBI Namesuberosol
Stars
DefinitionA tetracyclic triterpenoid that is 24-methylidenelanosta-7,9(11)-diene substituted by hydroxy groups at positions 3 and 15 (3β,15α stereoisomer). Isolated from Polyalthia suberosa, it exhibits anti-HIV activity.
Last Modified9 July 2013
DownloadsMolfile
FormulaC31H50O2
Net Charge0
Average Mass454.739
Monoisotopic Mass454.38108
SMILES[H][C@@]12CC=C3C(=CC[C@]4(C)[C@@]([H])([C@H](C)CCC(=C)C(C)C)C[C@H](O)[C@@]34C)[C@@]1(C)CC[C@H](O)C2(C)C
InChIInChI=1S/C31H50O2/c1-19(2)20(3)10-11-21(4)24-18-27(33)31(9)23-12-13-25-28(5,6)26(32)15-16-29(25,7)22(23)14-17-30(24,31)8/h12,14,19,21,24-27,32-33H,3,10-11,13,15-18H2,1-2,4-9H3/t21-,24-,25+,26+,27+,29-,30-,31-/m1/s1
InChIKeyMJRURUDEESYVHI-UJZFCZBUSA-N
Species of MetaboliteComponentSourceComments
Polyalthia suberosa (ncbitaxon:105757)
stem (BTO:0001300) PubMed (8377018)
leaf (BTO:0000713) PubMed (8377018)
Roles Classification
Biological Roles:
anti-HIV agent  An antiviral agent that destroys or inhibits the replication of the human immunodeficiency virus.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
suberosol (CHEBI:66531) has parent hydride lanostane (CHEBI:20265)
suberosol (CHEBI:66531) has role anti-HIV agent (CHEBI:64946)
suberosol (CHEBI:66531) has role metabolite (CHEBI:25212)
suberosol (CHEBI:66531) is a diol (CHEBI:23824)
suberosol (CHEBI:66531) is a tetracyclic triterpenoid (CHEBI:26893)
IUPAC Name 
(3β,15α)-24-methylidenelanosta-7,9(11)-diene-3,15-diol
Citations