CHEBI:70625 - cycloart-23-ene-3beta,25-diol

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ChEBI Name cycloart-23-ene-3beta,25-diol
ChEBI ID CHEBI:70625
Definition A natural product found in Lippia mexicana.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C30H50O2
Net Charge 0
Average Mass 442.71680
Monoisotopic Mass 442.38108
InChI InChI=1S/C30H50O2/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21-,22+,23+,24+,27-,28+,29-,30+/m1/s1
InChIKey JSPGKOBNHWTKNT-CPGXJQKCSA-N
SMILES [H][C@@]1(CC[C@@]2(C)[C@]3([H])CC[C@@]4([H])C(C)(C)[C@@H](O)CC[C@@]44C[C@@]34CC[C@]12C)[C@H](C)C\C=C\C(C)(C)O
Metabolite of Species Details
Lippia mexicana (IPNI:981940-1) Found in leaf (BTO:0000713). Dried and ground leaves, flowers, and stems were extracted with Me2CO and then with MeOH See: PubMed
Lippia mexicana (IPNI:981940-1) Found in flower (BTO:0000469). Dried and ground leaves, flowers, and stems were extracted with Me2CO and then with MeOH See: PubMed
Lippia mexicana (IPNI:981940-1) Found in stem (BTO:0001300). Dried and ground leaves, flowers, and stems were extracted with Me2CO and then with MeOH See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cycloart-23-ene-3beta,25-diol (CHEBI:70625) has role metabolite (CHEBI:25212)
cycloart-23-ene-3beta,25-diol (CHEBI:70625) is a triterpenoid (CHEBI:36615)
Synonym Source
(3beta,9beta,23E)-9,19-cyclolanost-23-ene-3,25-diol ChEBI
Citation Waiting for Citations Type Source
20942442 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:triterpenoid(CHEBI:36615); ISA:3beta-hydroxy steroid(CHEBI:36836); ISA:tertiary alcohol(CHEBI:26878); ISA:organic hydroxy compound(CHEBI:33822); ISA:secondary alcohol(CHEBI:35681);