[(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate

C17H33O7P-2 — CID 71296162

IUPAC[(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate
SMILESCCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])[O-]
InChIInChI=1S/C17H35O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(19)23-14-16(18)15-24-25(20,21)22/h16,18H,2-15H2,1H3,(H2,20,21,22)/p-2/t16-/m1/s1
InChIKeyFAZBDRGXCKPVJU-MRXNPFEDSA-L
MW380.42 g/mol
LogP2.44
Rot. Bonds17

About [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate

[(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate (PubChem CID 71296162) has the molecular formula C17H33O7P-2 and a molecular weight of 380.42 g/mol. Its IUPAC name is [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate.

Molecular Properties

Compound Name[(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate
PubChem CID71296162
Molecular FormulaC17H33O7P-2
Molecular Weight380.42 g/mol
Exact Mass380.20
IUPAC Name[(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate
SMILESCCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])[O-]
InChIInChI=1S/C17H35O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(19)23-14-16(18)15-24-25(20,21)22/h16,18H,2-15H2,1H3,(H2,20,21,22)/p-2/t16-/m1/s1
InChIKeyFAZBDRGXCKPVJU-MRXNPFEDSA-L
XLogP2.44
TPSA118.95 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds17
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.42
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

disodium;(3-dodecanoyloxy-2-hydroxypropyl) phosphate;propane-1,2,3-triol
CID 174684691
[(2R)-2-hydroxy-3-[(E)-octadec-11-enoyl]oxypropyl] phosphate
CID 129320279
[(2R)-3-[(E)-hexadec-9-enoyl]oxy-2-hydroxypropyl] phosphate
CID 146036944
sodium [(2R)-2-hydroxy-3-octadecanoyloxypropyl] hydrogen phosphate
CID 101184896
sodium [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] hydrogen phosphate
CID 101184897
[(2R)-2-hydroxy-3-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyl]oxypropyl] phosphate
CID 71627244
[2-hydroxy-3-[hydroxy-[2-hydroxy-3-[hydroxy-(2-hydroxy-3-octadecanoyloxypropoxy)phosphoryl]oxypropoxy]phosphoryl]oxypropyl] tetracosanoate
CID 165275592
[(2S)-2,3-dihydroxypropyl] [(2R)-2-hydroxy-3-octadecanoyloxypropyl] phosphate
CID 71296221
2,3-dihydroxypropyl [(2R)-3-hexadecanoyloxy-2-hydroxypropyl] phosphate
CID 86583415
[(2R)-3-decanoyloxy-2-hydroxypropyl] tridecanoate
CID 131799469
[(2R)-2-hydroxy-3-octanoyloxypropyl] pentadecanoate
CID 131799748
[(2S)-3-decanoyloxy-2-hydroxypropyl] nonadecanoate
CID 131799324

Frequently Asked Questions

What is the IUPAC name of [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate?
The IUPAC name of [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate (CID 71296162) is [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate.
What is the SMILES notation for [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate?
The canonical SMILES for [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate is CCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])[O-].
What is the InChIKey of [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate?
The InChIKey is FAZBDRGXCKPVJU-MRXNPFEDSA-L. The full InChI is InChI=1S/C17H35O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(19)23-14-16(18)15-24-25(20,21)22/h16,18H,2-15H2,1H3,(H2,20,21,22)/p-2/t16-/m1/s1.
What are the key properties of [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate?
[(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate has a molecular weight of 380.42 g/mol, XLogP of 2.44, 17 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate is sourced from PubChem (CID 71296162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).