Record Information
Version1.0
StatusDetected and Quantified
Creation Date2022-06-05 22:58:05 UTC
Update Date2022-09-01 02:27:46 UTC
Metabolite IDMMDBc0054191
Metabolite Identification
Common Name2,3-bis-O-(geranylgeranyl)-sn-glycerol 1-phosphate
Description2,3-bis-O-(geranylgeranyl)-sn-glycerol 1-phosphate, also known as 2,3-digeranylgeranyl sn-g-1-p, belongs to the class of organic compounds known as acyclic diterpenoids. These are diterpenoids (compounds made of four consecutive isoprene units) that do not contain a cycle. 2,3-bis-O-(geranylgeranyl)-sn-glycerol 1-phosphate is an extremely weak basic (essentially neutral) compound (based on its pKa).
Structure
Synonyms
ValueSource
2,3-Bis-O-(geranylgeranyl)-sn-glycerol-1-phosphateChEBI
2,3-Digeranylgeranyl sn-g-1-pChEBI
2,3-Digeranylgeranyl sn-glycerol 1-phosphateChEBI
2,3-Bis-O-(geranylgeranyl)-sn-glycerol-1-phosphoric acidGenerator
2,3-Digeranylgeranyl sn-glycerol 1-phosphoric acidGenerator
2,3-Bis-O-(geranylgeranyl)-sn-glycerol 1-phosphoric acidGenerator
2,3-Bis-O-(geranylgeranyl)glycerol 1-phosphoric acidGenerator
Molecular FormulaC43H73O6P
Average Mass717.025
Monoisotopic Mass716.514477069
IUPAC Name[(2S)-2,3-bis({[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl]oxy})propoxy]phosphonic acid
Traditional Name2,3-digeranylgeranyl sn-G-1-P
CAS Registry NumberNot Available
SMILES
CC(C)=CCC\C(C)=C\CC\C(C)=C\CC\C(C)=C\COC[C@@H](COP(O)(O)=O)OC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CCC=C(C)C
InChI Identifier
InChI=1S/C43H73O6P/c1-35(2)17-11-19-37(5)21-13-23-39(7)25-15-27-41(9)29-31-47-33-43(34-49-50(44,45)46)48-32-30-42(10)28-16-26-40(8)24-14-22-38(6)20-12-18-36(3)4/h17-18,21-22,25-26,29-30,43H,11-16,19-20,23-24,27-28,31-34H2,1-10H3,(H2,44,45,46)/b37-21+,38-22+,39-25+,40-26+,41-29+,42-30+/t43-/m0/s1
InChI KeyWHMXLRRVANEOOG-MVFIEKMPSA-N