CHEBI:69842 - Saniculamoid C

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ChEBI Name Saniculamoid C
ChEBI ID CHEBI:69842
Definition A natural product found in Sanicula lamelligera.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C15H28O4
Net Charge 0
Average Mass 272.38040
Monoisotopic Mass 272.19876
InChI InChI=1S/C15H28O4/c1-13(2,17)11-7-10-9(5-6-14(10,3)18)15(4,19)8-12(11)16/h9-12,16-19H,5-8H2,1-4H3/t9-,10-,11-,12-,14+,15+/m0/s1
InChIKey HASSBFRDJUITDM-OOAGNDBOSA-N
SMILES [H][C@]12CC[C@@](C)(O)[C@@]1([H])C[C@@H]([C@@H](O)C[C@@]2(C)O)C(C)(C)O
Metabolite of Species Details
Sanicula lamelligera (NCBI:txid84533) Found in whole plant (BTO:0001461). 80% aqueous ethanolic extract of dried, powdered whole plant 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 Saniculamoid C (CHEBI:69842) has role metabolite (CHEBI:25212)
Saniculamoid C (CHEBI:69842) is a sesquiterpenoid (CHEBI:26658)
Synonym Source
(1R,3aS,4R,6S,7S,8aS)-7-(2-Hydroxy-2-propanyl)-1,4-dimethyldecahydro-1,4,6-azulenetriol ChEBI
Citation Waiting for Citations Type Source
21561060 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:tertiary alcohol(CHEBI:26878); ISA:secondary alcohol(CHEBI:35681); ISA:polyol(CHEBI:26191); ISA:organic hydroxy compound(CHEBI:33822);