CHEBI:176803 - presqualene monophosphate(2−)

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ChEBI Name presqualene monophosphate(2−)
ChEBI ID CHEBI:176803
ChEBI ASCII Name presqualene monophosphate(2-)
Definition A double charged organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of presqualene monophosphate. Major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Elisabeth COUDERT
Supplier Information
Download Molfile XML SDF
Formula C30H49O4P
Net Charge -2
Average Mass 504.693
Monoisotopic Mass 504.33794
InChI InChI=1S/C30H51O4P/c1-23(2)13-9-15-25(5)17-11-18-27(7)21-28-29(22-34-35(31,32)33)30(28,8)20-12-19-26(6)16-10-14-24(3)4/h13-14,17,19,21,28-29H,9-12,15-16,18,20,22H2,1-8H3,(H2,31,32,33)/p-2/b25-17+,26-19+,27-21+/t28-,29-,30-/m0/s1
InChIKey GPKFJNOMPPCLGX-VYCBRMPGSA-L
SMILES CC(C)=CCC\C(C)=C\CC\C(C)=C\[C@H]1[C@H](COP([O-])([O-])=O)[C@@]1(C)CC\C=C(/C)CCC=C(C)C
ChEBI Ontology
Outgoing presqualene monophosphate(2−) (CHEBI:176803) has functional parent presqualene alcohol (CHEBI:176962)
presqualene monophosphate(2−) (CHEBI:176803) is a organophosphate oxoanion (CHEBI:58945)
presqualene monophosphate(2−) (CHEBI:176803) is conjugate base of presqualene monophosphate (CHEBI:134117)
Incoming presqualene monophosphate (CHEBI:134117) is conjugate acid of presqualene monophosphate(2−) (CHEBI:176803)
IUPAC Name
{(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(1E,5E)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropyl}methyl phosphate
Synonyms Sources
presqualene monophosphate dianion ChEBI
presqualene phosphate UniProt
Citations Waiting for Citations Types Sources
16464866 PubMed citation Europe PMC
23568778 PubMed citation Europe PMC
Last Modified
10 January 2024