CHEBI:67761 - Illicidione B

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ChEBI Name Illicidione B
ChEBI ID CHEBI:67761
Definition A natural product found in Illicium oligandrum.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C29H36O8
Net Charge 0
Average Mass 512.59130
Monoisotopic Mass 512.24102
InChI InChI=1S/C29H36O8/c1-7-9-16-12-28(34)14-20(26(3,4)32)36-24(28)18(22(16)30)11-19-23(31)17(10-8-2)13-29(35)15-21(27(5,6)33)37-25(19)29/h7-8,12-13,20-21,32-35H,1-2,9-11,14-15H2,3-6H3/t20-,21-,28+,29+/m1/s1
InChIKey AVMQANMZZMKFSS-SKZNYKRCSA-N
SMILES CC(C)(O)[C@H]1C[C@@]2(O)C=C(CC=C)C(=O)C(CC3=C4O[C@H](C[C@@]4(O)C=C(CC=C)C3=O)C(C)(C)O)=C2O1
Metabolite of Species Details
Illicium oligandrum (NCBI:txid145286) Found in stem (BTO:0001300). Previous component: stem bark; 95% ethanolic extract of air-dried stem bark 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 Illicidione B (CHEBI:67761) has role metabolite (CHEBI:25212)
Illicidione B (CHEBI:67761) is a disaccharide (CHEBI:36233)
Citation Waiting for Citations Type Source
21524101 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:benzofurans(CHEBI:35259); ISA:oxolanes(CHEBI:26912); ISA:tertiary alcohol(CHEBI:26878); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:cyclic ketone(CHEBI:3992); ISA:ether(CHEBI:25698);