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CHEBI:50060 - ent-cassa-12,15-diene

Default Structure
ChEBI IDCHEBI:50060
ChEBI Nameent-cassa-12,15-diene
Stars
ASCII Nameent-cassa-12,15-diene
Last Modified17 January 2018
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC20H32
Net Charge0
Average Mass272.476
Monoisotopic Mass272.25040
SMILES[H][C@@]12CC=C(C=C)[C@@H](C)[C@@]1([H])CC[C@]1([H])C(C)(C)CCC[C@@]21C
InChIInChI=1S/C20H32/c1-6-15-8-10-17-16(14(15)2)9-11-18-19(3,4)12-7-13-20(17,18)5/h6,8,14,16-18H,1,7,9-13H2,2-5H3/t14-,16-,17-,18-,20+/m1/s1
InChIKeyJQPDOKGAOXSRJD-SVEODPQUSA-N
ChEBI Ontology
Outgoing Relation(s)
ent-cassa-12,15-diene (CHEBI:50060) is a diterpene (CHEBI:35190)
Incoming Relation(s)
ent-3β-hydroxycassa-12,15-dien-2-one (CHEBI:138970) has parent hydride ent-cassa-12,15-diene (CHEBI:50060)
ent-cassa-12,15-dien-2-one (CHEBI:138969) has parent hydride ent-cassa-12,15-diene (CHEBI:50060)
ent-cassa-12,15-dien-2β-ol (CHEBI:138967) has parent hydride ent-cassa-12,15-diene (CHEBI:50060)
ent-cassa-12,15-dien-2β,3β-diol (CHEBI:138968) has parent hydride ent-cassa-12,15-diene (CHEBI:50060)
ent-cassa-12,15-dien-3β-ol (CHEBI:72660) has parent hydride ent-cassa-12,15-diene (CHEBI:50060)
11-oxo-ent-cassa-12,15-dien-2β,3β-diol (CHEBI:72661) has parent hydride ent-cassa-12,15-diene (CHEBI:50060)
11-oxo-ent-cassa-12,15-dien-3α-ol (CHEBI:72658) has parent hydride ent-cassa-12,15-diene (CHEBI:50060)
11α-hydroxy-ent-cassa-12,15-diene (CHEBI:63662) has parent hydride ent-cassa-12,15-diene (CHEBI:50060)
IUPAC Name 
5β,8α,9β,10α,14β-13-ethenyl-14-methylpodocarp-12-ene
Synonym  Source
5β,8α,9β,10α,14β-14-methyl-13-vinylpodocarp-12-eneIUPAC
UniProt Name  Source
ent-cassa-12,15-dieneUniProt
Manual XrefsDatabases
C18226KEGG COMPOUND
Registry NumbersSources
Beilstein:9644185Beilstein