(8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one

C23H38O2 — CID 10360291

IUPAC(8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)CCCO
InChIInChI=1S/C23H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(25)21-19-22-24/h6-7,9-10,12-13,15-16,24H,2-5,8,11,14,17-22H2,1H3/b7-6-,10-9-,13-12-,16-15-
InChIKeyREKBPVNFOXDNRG-DOFZRALJSA-N
MW346.56 g/mol
LogP6.47
Rot. Bonds17

About (8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one

(8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one (PubChem CID 10360291) has the molecular formula C23H38O2 and a molecular weight of 346.56 g/mol. Its IUPAC name is (8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one.

Molecular Properties

Compound Name(8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one
PubChem CID10360291
Molecular FormulaC23H38O2
Molecular Weight346.56 g/mol
Exact Mass346.29
IUPAC Name(8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)CCCO
InChIInChI=1S/C23H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(25)21-19-22-24/h6-7,9-10,12-13,15-16,24H,2-5,8,11,14,17-22H2,1H3/b7-6-,10-9-,13-12-,16-15-
InChIKeyREKBPVNFOXDNRG-DOFZRALJSA-N
XLogP6.47
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds17
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.56
LogP ≤ 56.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one 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

1,3-Dihydroxy-8-decen-5-one
CID 5283272
Strophanthus acid
CID 131839803
17-Home(9Z)
CID 5312772
(Z)-1-hydroxyhexadec-10-en-7-one
CID 13964640
Paleic Acid
CID 52950131
(Z,9R)-9-hydroxyoctadec-12-enoic acid
CID 5312848
(12Z,15Z)-1-Hydroxy-henicosa-12,15-dien-4-one
CID 44302161
(Z)-15-hydroxyicos-11-enoic acid
CID 13724030
sodium (Z)-19-hydroxyicos-5-enoate
CID 130408134
9-Hydroxyoctadec-12-enoic acid, (Z)-
CID 5282941
13-Hydroxy-cis-9-octadecenoic acid
CID 88183365
1,3-Dihydroxydec-8-en-5-one
CID 336434

Frequently Asked Questions

What is the IUPAC name of (8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one?
The IUPAC name of (8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one (CID 10360291) is (8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one.
What is the SMILES notation for (8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one?
The canonical SMILES for (8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one is CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)CCCO.
What is the InChIKey of (8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one?
The InChIKey is REKBPVNFOXDNRG-DOFZRALJSA-N. The full InChI is InChI=1S/C23H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(25)21-19-22-24/h6-7,9-10,12-13,15-16,24H,2-5,8,11,14,17-22H2,1H3/b7-6-,10-9-,13-12-,16-15-.
What are the key properties of (8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one?
(8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one has a molecular weight of 346.56 g/mol, XLogP of 6.47, 17 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8Z,11Z,14Z,17Z)-1-hydroxytricosa-8,11,14,17-tetraen-4-one is sourced from PubChem (CID 10360291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).