CHEBI:69495 - Sphaeropsidin C

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ChEBI Name Sphaeropsidin C
ChEBI ID CHEBI:69495
Definition A natural product found in Smardaea species and Diplodia cupressi.
Stars This entity has been manually annotated by a third party.
Supplier Information ZINC000059211766
Download Molfile XML SDF
Formula C20H28O4
Net Charge 0
Average Mass 332.43390
Monoisotopic Mass 332.19876
InChI InChI=1S/C20H28O4/c1-5-18(4)9-10-20(24)13(12-18)14(21)11-15-17(2,3)7-6-8-19(15,20)16(22)23/h5,12,15,24H,1,6-11H2,2-4H3,(H,22,23)/t15-,18-,19-,20+/m0/s1
InChIKey VIDNIVWPSMVGJV-MVJPYGJCSA-N
SMILES [H][C@@]12CC(=O)C3=C[C@](C)(CC[C@]3(O)[C@]1(CCCC2(C)C)C(O)=O)C=C
Metabolite of Species Details
Smardaea (NCBI:txid173111) Ethyl acetate extract,Endophytic fungus in the living photosynthetic tissue of Ceratodon purpureus. of strain AZ0432 See: PubMed
Xylaria (NCBI:txid37991) Ethyl acetate extract of broth, fungus isolated from an undefined dead wood of strain BCC 4297 See: PubMed
Diplodia cupressi (NCBI:txid400389) of strain 261.85CBS 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 Sphaeropsidin C (CHEBI:69495) has role metabolite (CHEBI:25212)
Sphaeropsidin C (CHEBI:69495) is a tricyclic diterpenoid (CHEBI:79084)
Synonym Source
(13alpha)-9-Hydroxy-7-oxopimara-8(14),15-dien-20-oic acid ChEBI
Citations
Last Modified
20 May 2016
General Comment
2014-10-17 Suggested Classification: ISA:cyclohexanones(CHEBI:23482); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:tertiary alcohol(CHEBI:26878); ISA:organic hydroxy compound(CHEBI:33822); ISA:monocarboxylic acid(CHEBI:25384); ISA:carboxylic acid(CHEBI:33575); ISA:organonitrogen compound(CHEBI:35352);