CHEBI:84603 - all-trans-tridecaprenyl diphosphate(3−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name all-trans-tridecaprenyl diphosphate(3−)
ChEBI ID CHEBI:84603
ChEBI ASCII Name all-trans-tridecaprenyl diphosphate(3-)
Definition An all-trans-polyprenyl diphosphate(3−) arising from deprotonation of the diphosphate OH groups of all-trans-tridecaprenyl diphosphate; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C65H105O7P2
Net Charge -3
Average Mass 1060.47420
Monoisotopic Mass 1059.73520
InChI InChI=1S/C65H108O7P2/c1-53(2)27-15-28-54(3)29-16-30-55(4)31-17-32-56(5)33-18-34-57(6)35-19-36-58(7)37-20-38-59(8)39-21-40-60(9)41-22-42-61(10)43-23-44-62(11)45-24-46-63(12)47-25-48-64(13)49-26-50-65(14)51-52-71-74(69,70)72-73(66,67)68/h27,29,31,33,35,37,39,41,43,45,47,49,51H,15-26,28,30,32,34,36,38,40,42,44,46,48,50,52H2,1-14H3,(H,69,70)(H2,66,67,68)/p-3/b54-29+,55-31+,56-33+,57-35+,58-37+,59-39+,60-41+,61-43+,62-45+,63-47+,64-49+,65-51+
InChIKey DZNALTJEOIIEJL-IBZXXNHPSA-K
SMILES CC(C)=CCC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\COP([O-])(=O)OP([O-])([O-])=O
ChEBI Ontology
Outgoing all-trans-tridecaprenyl diphosphate(3−) (CHEBI:84603) is a all-trans-polyprenyl diphosphate(3−) (CHEBI:58914)
all-trans-tridecaprenyl diphosphate(3−) (CHEBI:84603) is conjugate base of all-trans-tridecaprenyl diphosphate (CHEBI:84600)
Incoming all-trans-tridecaprenyl diphosphate (CHEBI:84600) is conjugate acid of all-trans-tridecaprenyl diphosphate(3−) (CHEBI:84603)
Synonyms Sources
(3−) ChEBI
all-trans-tridecaprenyl diphosphate UniProt
all-trans-tridecaprenyl pyrophosphate(3−) ChEBI
tridecaprenyl diphosphate MetaCyc
Manual Xref Database
CPD-9972 MetaCyc
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Last Modified
08 April 2015