CHEBI:69784 - shizukaol C

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ChEBI Name shizukaol C
ChEBI ID CHEBI:69784
Definition A natural product found in Chloranthus japonicus.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C36H42O10
Net Charge 0
Average Mass 634.71270
Monoisotopic Mass 634.27780
InChI InChI=1S/C36H42O10/c1-14(7-25(38)44-5)12-35(43)22-10-21(22)33(3)23(35)11-20-18(13-37)32(42)46-36(20)24(33)9-17-16-8-19(16)34(4)27(17)28(36)26(29(39)30(34)40)15(2)31(41)45-6/h7,16,19,21-24,28,30,37,40,43H,8-13H2,1-6H3/b14-7+,26-15-/t16-,19-,21-,22+,23+,24+,28+,30+,33+,34+,35-,36+/m1/s1
InChIKey FOGQAGLJUKZQEX-WLPCRHHKSA-N
SMILES [H][C@]12C[C@@]1([H])[C@]1(C)[C@@H](O)C(=O)\C(=C(\C)C(=O)OC)[C@@]3([H])C1=C2C[C@@]1([H])[C@@]2(C)[C@]4([H])C[C@]4([H])[C@](O)(C\C(C)=C\C(=O)OC)[C@@]2([H])CC2=C(CO)C(=O)O[C@]312
Metabolite of Species Details
Chloranthus japonicus (NCBI:txid13007) Found in whole plant (BTO:0001461). Methanolic extract of dried and powdered 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 shizukaol C (CHEBI:69784) has role metabolite (CHEBI:25212)
shizukaol C (CHEBI:69784) is a triterpenoid (CHEBI:36615)
Citation Waiting for Citations Type Source
21650224 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:terpene lactone(CHEBI:37668); ISA:carbonyl compound(CHEBI:36586); ISA:fatty acid ester(CHEBI:35748); ISA:cyclohexanones(CHEBI:23482); ISA:butenolide(CHEBI:50523); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:carboxylic ester(CHEBI:33308); ISA:tertiary alcohol(CHEBI:26878); ISA:enoate ester(CHEBI:51702); ISA:lactone(CHEBI:25000); ISA:secondary alcohol(CHEBI:35681); ISA:organic hydroxy compound(CHEBI:33822); ISA:ether(CHEBI:25698); ISA:organonitrogen compound(CHEBI:35352); ISA:primary alcohol(CHEBI:15734);