CHEBI:67791 - Blumeaene E2

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ChEBI Name Blumeaene E2
ChEBI ID CHEBI:67791
Definition A natural product found in Blumea balsamifera.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H30O6
Net Charge 0
Average Mass 366.44860
Monoisotopic Mass 366.20424
InChI InChI=1S/C20H30O6/c1-10(2)13-9-14(25-17(22)18(5)12(4)26-18)19(6,23)20(24)8-7-11(3)15(20)16(13)21/h10,12-14,23-24H,7-9H2,1-6H3/t12-,13+,14+,18-,19-,20+/m1/s1
InChIKey IKMKRVIHSCZYGK-SKUUSRGCSA-N
SMILES CC(C)[C@@H]1C[C@H](OC(=O)[C@]2(C)O[C@@H]2C)[C@@](C)(O)[C@]2(O)CCC(C)=C2C1=O
Metabolite of Species Details
Blumea balsamifera (NCBI:txid313920) Found in leaf (BTO:0000713). Methanolic extract of air-dried, powdered leaves 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 Blumeaene E2 (CHEBI:67791) has role metabolite (CHEBI:25212)
Blumeaene E2 (CHEBI:67791) is a sesquiterpenoid (CHEBI:26658)
Citation Waiting for Citations Type Source
21319848 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:epoxide(CHEBI:32955); ISA:carboxylic acid(CHEBI:33575); ISA:tertiary alcohol(CHEBI:26878); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:ketone(CHEBI:17087); ISA:polyol(CHEBI:26191); ISA:carboxylic ester(CHEBI:33308); ISA:organic hydroxy compound(CHEBI:33822); ISA:ether(CHEBI:25698); ISA:organonitrogen compound(CHEBI:35352); ISA:monocarboxylic acid(CHEBI:25384);