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CHEBI:177441 - 4beta-Phorbol

ChEBI IDCHEBI:177441
ChEBI Name4beta-Phorbol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H28O6
Net Charge0
Average Mass364.438
Monoisotopic Mass364.18859
SMILESCC1=CC2[C@@]3(O)C(C)C(O)[C@]4(O)C(C3C=C(CO)C[C@]2(O)C1=O)C4(C)C
InChIInChI=1S/C20H28O6/c1-9-5-13-18(24,15(9)22)7-11(8-21)6-12-14-17(3,4)20(14,26)16(23)10(2)19(12,13)25/h5-6,10,12-14,16,21,23-26H,7-8H2,1-4H3/t10?,12?,13?,14?,16?,18-,19-,20-/m1/s1
InChIKeyQGVLYPPODPLXMB-LHAAJPOVSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) Sausage (ENVO:00002166) MetaboLights (MTBLS2871)
ChEBI Ontology
Outgoing Relation(s)
4beta-Phorbol (CHEBI:177441) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(1S,6R,13S)-1,6,13,14-tetrahydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyltetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dien-5-one