CHEBI:69467 - (2S,3S)-pterosin C

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (2S,3S)-pterosin C
ChEBI ID CHEBI:69467
Definition A natural product found in Acrostichum aureum.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C14H18O3
Net Charge 0
Average Mass 234.29090
Monoisotopic Mass 234.12559
InChI InChI=1S/C14H18O3/c1-7-6-11-12(8(2)10(7)4-5-15)14(17)9(3)13(11)16/h6,9,13,15-16H,4-5H2,1-3H3/t9-,13-/m0/s1
InChIKey QQPCNRKHGFIVLH-ZANVPECISA-N
SMILES C[C@H]1[C@H](O)c2cc(C)c(CCO)c(C)c2C1=O
Metabolite of Species Details
Acrostichum aureum (NCBI:txid29594) Found in aerial part (BTO:0001658). Methanolic extract of dried and pulverized aerial parts 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 (2S,3S)-pterosin C (CHEBI:69467) has role metabolite (CHEBI:25212)
(2S,3S)-pterosin C (CHEBI:69467) is a indanones (CHEBI:24789)
Synonym Source
(2S,3S)-3-hydroxy-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one ChEBI
Registry Number Type Source
35938-43-3 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
21899268 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:aromatic ketone(CHEBI:76224); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:secondary alcohol(CHEBI:35681); ISA:organic heterocyclic compound(CHEBI:24532); ISA:primary alcohol(CHEBI:15734);