PGP161 – Phosphatidylglycerophosphate (dihexadec-9-enoyl, n-C16:1)

Name
WID	PGP161
Name	Phosphatidylglycerophosphate (dihexadec-9-enoyl, n-C16:1)
Traditional name	1-(hexadec-9-enoyloxy)-3-({[2-hydroxy-3-(phosphonatooxy)propyl] phosphonato}oxy)propan-2-yl hexadec-9-enoate
IUPAC name	1-(hexadec-9-enoyloxy)-3-({[2-hydroxy-3-(phosphonatooxy)propyl] phosphonato}oxy)propan-2-yl hexadec-9-enoate
Cross references	PubChem: 6624, KEGG: C03892, LIPIDMAPS: LMGP05010000, BiGG: pgp161

Classification
Type	lipid_glycerophospholipid_phosphatidylglycerol_phosphate

Structure
Empirical formula (pH 7.5)	H₆₉C₃₈O₁₃P₂
SMILES (pH 7.5)	CCCCCCC=CCCCCCCCC(=O)OCC(COP([O-])(=O)OCC(O)COP([O-])([O-])=O)OC(=O)CCCCCCCC=CCCCCCC
Charge (pH 7.5)	-3
Is hydrophobic	True
Molecular weight (Da)	795.89
van der Waals volume (pH 7.5; Å³ molecule^‑1)	774.13
Δ_fG^'o (pH 7.5, 25C, I = 0; kJ mol^‑1)	0.0
logP	10.09
logD (pH 7.5)	4.59

Concentrations
Biomass composition (SP4 media, 5% CO₂, 37C; mmol gDCW^‑1)	0.0216999 [m]

Function
Reaction participant	Phosphatidylglycerol synthase (n-C16:1) CDPDG161[m] + GL3P[c] ⇔ CMP[c] + (2) H[c] + PGP161[m] phosphatidylglycerol phosphate phosphatase (n-C16:1) H2O[c] + PGP161[m] ⇒ PG161[m] + PI[c]

Metadata
Created	2012-10-01 15:07:06
Last updated	2012-10-01 15:12:28