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CHEBI:176803 - presqualene monophosphate(2−)

ChEBI IDCHEBI:176803
ChEBI Namepresqualene monophosphate(2−)
Stars
ASCII Namepresqualene monophosphate(2-)
DefinitionA double charged organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of presqualene monophosphate. Major species at pH 7.3.
Last Modified10 January 2024
SubmitterElisabeth Coudert
DownloadsMolfile
FormulaC30H49O4P
Net Charge-2
Average Mass504.692
Monoisotopic Mass504.33794
SMILESCC(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
InChIInChI=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
InChIKeyGPKFJNOMPPCLGX-VYCBRMPGSA-L
ChEBI Ontology
Outgoing Relation(s)
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 Relation(s)
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
Synonym  Source
presqualene monophosphate dianionChEBI
UniProt Name  Source
presqualene phosphateUniProt
Citations