CHEBI:23375 - copalyl diphosphate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name copalyl diphosphate
ChEBI ID CHEBI:23375
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C20H36O7P2
Net Charge 0
Average Mass 450.44316
Monoisotopic Mass 450.19363
InChI InChI=1S/C20H36O7P2/c1-15(11-14-26-29(24,25)27-28(21,22)23)7-9-17-16(2)8-10-18-19(3,4)12-6-13-20(17,18)5/h11,17-18H,2,6-10,12-14H2,1,3-5H3,(H,24,25)(H2,21,22,23)/b15-11+
InChIKey JCAIWDXKLCEQEO-RVDMUPIBSA-N
SMILES C\C(CCC1C(=C)CCC2C(C)(C)CCCC12C)=C/COP(O)(=O)OP(O)(O)=O
ChEBI Ontology
Outgoing copalyl diphosphate (CHEBI:23375) is a carbobicyclic compound (CHEBI:36785)
copalyl diphosphate (CHEBI:23375) is a diterpenyl phosphate (CHEBI:36772)
copalyl diphosphate (CHEBI:23375) is a labdane diterpenoid (CHEBI:36770)
Incoming 5α,9α,10β-labda-8(20),13-dien-15-yl diphosphate (CHEBI:30939) is a copalyl diphosphate (CHEBI:23375)
5α,9β,10α-labda-8(20),13-dien-15-yl diphosphate (CHEBI:29739) is a copalyl diphosphate (CHEBI:23375)
5β,9α,10α-labda-8(20),13-dien-15-yl diphosphate (CHEBI:28151) is a copalyl diphosphate (CHEBI:23375)
IUPAC Name
3-methyl-5-(5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl)pent-2-en-1-yl trihydrogen phosphate
Manual Xref Database
C06089 KEGG COMPOUND
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Last Modified
17 July 2018