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CHEBI:64282 - (Z)-biformene

ChEBI IDCHEBI:64282
ChEBI Name(Z)-biformene
Stars
ASCII Name(Z)-biformene
DefinitionA diterpene that consists of a labdane skeleton with double bonds at C-8(17), C-12(13) and C-14 (the Z-isomer) and inversion of stereochemistry at the 5, 9 and 10 positions.
Last Modified15 January 2014
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC20H32
Net Charge0
Average Mass272.476
Monoisotopic Mass272.25040
SMILES[H][C@@]1(C/C=C(/C)C=C)C(=C)CC[C@]2([H])C(C)(C)CCC[C@@]12C
InChIInChI=1S/C20H32/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h7,9,17-18H,1,3,8,10-14H2,2,4-6H3/b15-9-/t17-,18-,20+/m1/s1
InChIKeyVJVMMXUPZGOBSN-ZMYBETPQSA-N
ChEBI Ontology
Outgoing Relation(s)
(Z)-biformene (CHEBI:64282) has parent hydride labdane (CHEBI:36505)
(Z)-biformene (CHEBI:64282) is a diterpene (CHEBI:35190)
IUPAC Name 
(4aR,5R,8aR)-1,1,4a-trimethyl-6-methylene-5-[(2Z)-3-methylpenta-2,4-dien-1-yl]decahydronaphthalene
Synonym  Source
5β,9α,10α-labda-8(17),12E,14-trieneChEBI
UniProt Name  Source
(Z)-biformeneUniProt
Manual XrefsDatabases
CPD-14026MetaCyc
Registry NumbersSources
Reaxys:19934375Reaxys