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CHEBI:217360 - Phomactin P

Default Structure
ChEBI IDCHEBI:217360
ChEBI NamePhomactin P
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H28O3
Net Charge0
Average Mass316.441
Monoisotopic Mass316.20384
SMILESC=C1C2=CC[C@@H](C)[C@]1(C)CC[C@]1(C)O[C@H]1CC[C@@]1(C)O[C@@H]1C2=O
InChIInChI=1S/C20H28O3/c1-12-6-7-14-13(2)18(12,3)10-11-19(4)15(22-19)8-9-20(5)17(23-20)16(14)21/h7,12,15,17H,2,6,8-11H2,1,3-5H3/t12-,15+,17-,18+,19+,20-/m1/s1
InChIKeyRLGDFSBCUIFXDS-MIVADNKTSA-N
ChEBI Ontology
Outgoing Relation(s)
Phomactin P (CHEBI:217360) is a ketone (CHEBI:17087)
IUPAC Name 
(3S,5R,8S,10S,13S,14R)-5,10,13,14-tetramethyl-17-methylidene-4,9-dioxatetracyclo[11.3.1.03,5.08,10]heptadec-1(16)-en-2-one