CHEBI:216979 - Phomopsisin C

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ChEBI Name Phomopsisin C
ChEBI ID CHEBI:216979
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H33NO4
Net Charge 0
Average Mass 375.509
Monoisotopic Mass 375.24096
InChI InChI=1S/C22H33NO4/c1-13(2)11-18-20-14(3)7-8-15-9-10-16(24)5-4-6-17(25)12-19(26)22(15,20)21(27)23-18/h7-10,13-18,20,24-25H,4-6,11-12H2,1-3H3,(H,23,27)/t14-,15-,16+,17+,18+,20+,22-/m1/s1
InChIKey XBCWIGDRZOIINM-ODCGGSMJSA-N
SMILES O=C1[C@@]23C(=O)N[C@H]([C@@H]2[C@H](C)C=C[C@@H]3C=C[C@@H](O)CCC[C@@H](C1)O)CC(C)C
Metabolite of Species Details
Phomopsis (NCBI:txid34399) See: DOI
Roles Classification
Biological Role(s): fungal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Phomopsisin C (CHEBI:216979) has role fungal metabolite (CHEBI:76946)
Phomopsisin C (CHEBI:216979) is a cytochalasin (CHEBI:23528)
IUPAC Name
(1S,4S,8S,11R,14R,15R,16S)-4,8-dihydroxy-14-methyl-16-(2-methylpropyl)-17-azatricyclo[9.7.0.01,15]octadeca-9,12-diene-2,18-dione