CHEBI:28151 - 5β,9α,10α-labda-8(20),13-dien-15-yl diphosphate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5β,9α,10α-labda-8(20),13-dien-15-yl diphosphate
ChEBI ID CHEBI:28151
ChEBI ASCII Name 5beta,9alpha,10alpha-labda-8(20),13-dien-15-yl diphosphate
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:3873, CHEBI:12813
Supplier Information
Download Molfile XML SDF
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+/t17-,18-,20+/m1/s1
InChIKey JCAIWDXKLCEQEO-PGHZQYBFSA-N
SMILES [H][C@]12CCC(=C)[C@@H](CC\C(C)=C\COP(O)(=O)OP(O)(O)=O)[C@]1(C)CCCC2(C)C
ChEBI Ontology
Outgoing 5β,9α,10α-labda-8(20),13-dien-15-yl diphosphate (CHEBI:28151) is a copalyl diphosphate (CHEBI:23375)
5β,9α,10α-labda-8(20),13-dien-15-yl diphosphate (CHEBI:28151) is conjugate acid of 5β,9α,10α-labda-8(20),13-dien-15-yl diphosphate(3−) (CHEBI:58553)
5β,9α,10α-labda-8(20),13-dien-15-yl diphosphate (CHEBI:28151) is enantiomer of 5α,9α,10β-labda-8(20),13-dien-15-yl diphosphate (CHEBI:30939)
Incoming 5β,9α,10α-labda-8(20),13-dien-15-yl diphosphate(3−) (CHEBI:58553) is conjugate base of 5β,9α,10α-labda-8(20),13-dien-15-yl diphosphate (CHEBI:28151)
5α,9α,10β-labda-8(20),13-dien-15-yl diphosphate (CHEBI:30939) is enantiomer of 5β,9α,10α-labda-8(20),13-dien-15-yl diphosphate (CHEBI:28151)
IUPAC Names
3-methyl-5-[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]pent-2-en-1-yl trihydrogen diphosphate
5β,9α,10α-labda-8(20),13-dien-15-yl trihydrogen diphosphate
Synonyms Sources
(-)-Copalyl diphosphate KEGG COMPOUND
5α,9α,10β-labda-8(20),13-dien-15-yl diphosphate JCBN
ent-Copalyl diphosphate KEGG COMPOUND
Manual Xrefs Databases
C00000880 KNApSAcK
C06089 KEGG COMPOUND
LMPR0104030001 LIPID MAPS
View more database links
Registry Number Type Source
8594375 Beilstein Registry Number Beilstein
Last Modified
04 July 2018