CHEBI:69496 - Sphaeropsidin D

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ChEBI Name Sphaeropsidin D
ChEBI ID CHEBI:69496
Definition A natural product found in Smardaea species and Diplodia cupressi.
Stars This entity has been manually annotated by a third party.
Supplier Information ZINC000032296380
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Formula C20H26O6
Net Charge 0
Average Mass 362.41680
Monoisotopic Mass 362.17294
InChI InChI=1S/C20H26O6/c1-5-17(4)9-11-13(22)20(25)14-16(2,3)7-6-8-18(14,15(23)26-20)19(11,24)12(21)10-17/h5,9,12,14,21,24-25H,1,6-8,10H2,2-4H3/t12-,14+,17-,18+,19+,20-/m1/s1
InChIKey RGMZNUAVQHIGNL-WSFBEDDRSA-N
SMILES [H][C@]12C(C)(C)CCC[C@@]11C(=O)O[C@]2(O)C(=O)C2=C[C@](C)(C[C@@H](O)[C@]12O)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
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.
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ChEBI Ontology
Outgoing Sphaeropsidin D (CHEBI:69496) has role metabolite (CHEBI:25212)
Sphaeropsidin D (CHEBI:69496) is a γ-lactone (CHEBI:37581)
Synonym Source
9alpha,11alpha-dihydroxy-7-oxopimara-8(14),15-dien-20-oic acid 6,20-lactone ChEBI
Citations Waiting for Citations
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:cyclohexanones(CHEBI:23482); ISA:oxacycle(CHEBI:38104); ISA:ketone(CHEBI:17087); ISA:carboxylic ester(CHEBI:33308); ISA:oxolanes(CHEBI:26912); ISA:tertiary alcohol(CHEBI:26878); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:hemiacetal(CHEBI:5653); ISA:organic hydroxy compound(CHEBI:33822); ISA:secondary alcohol(CHEBI:35681); ISA:polyol(CHEBI:26191);