CHEBI:84599 - all-trans-dodecaprenyl diphosphate

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ChEBI Name all-trans-dodecaprenyl diphosphate
ChEBI ID CHEBI:84599
ChEBI ASCII Name all-trans-dodecaprenyl diphosphate
Definition An all-trans-polyprenyl diphosphate composed from twelve isoprenyl units.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information
Download Molfile XML SDF
Formula C60H100O7P2
Net Charge 0
Average Mass 995.37930
Monoisotopic Mass 994.69443
InChI InChI=1S/C60H100O7P2/c1-49(2)25-14-26-50(3)27-15-28-51(4)29-16-30-52(5)31-17-32-53(6)33-18-34-54(7)35-19-36-55(8)37-20-38-56(9)39-21-40-57(10)41-22-42-58(11)43-23-44-59(12)45-24-46-60(13)47-48-66-69(64,65)67-68(61,62)63/h25,27,29,31,33,35,37,39,41,43,45,47H,14-24,26,28,30,32,34,36,38,40,42,44,46,48H2,1-13H3,(H,64,65)(H2,61,62,63)/b50-27+,51-29+,52-31+,53-33+,54-35+,55-37+,56-39+,57-41+,58-43+,59-45+,60-47+
InChIKey WURMRKUXTPWSRM-GNZYJLLNSA-N
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\COP(O)(=O)OP(O)(O)=O
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
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ChEBI Ontology
Outgoing all-trans-dodecaprenyl diphosphate (CHEBI:84599) has role human metabolite (CHEBI:77746)
all-trans-dodecaprenyl diphosphate (CHEBI:84599) is a all-trans-polyprenyl diphosphate (CHEBI:55337)
all-trans-dodecaprenyl diphosphate (CHEBI:84599) is conjugate acid of all-trans-dodecaprenyl diphosphate(3−) (CHEBI:84602)
Incoming all-trans-dodecaprenyl diphosphate(3−) (CHEBI:84602) is conjugate base of all-trans-dodecaprenyl diphosphate (CHEBI:84599)
IUPAC Name
(2E,6E,10E,14E,18E,22E,26E,30E,34E,38E,42E)-3,7,11,15,19,23,27,31,35,39,43,47-dodecamethyloctatetraconta-2,6,10,14,18,22,26,30,34,38,42,46-dodecaen-1-yl trihydrogen diphosphate
Synonym Source
all-trans-dodecaprenyl pyrophosphate ChEBI
Manual Xrefs Databases
CPD-9650 MetaCyc
HMDB0012217 HMDB
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Last Modified
08 April 2015