(4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol

C22H26O — CID 10357825

IUPAC(4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol
SMILESC#C/C=C\CCCCCCC#CC#CCCC/C=C\C#CCO
InChIInChI=1S/C22H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h1,3-4,18-19,23H,5-10,15-17,22H2/b4-3-,19-18-
InChIKeyQZOMSTWCVSLZGH-WLXZLGQWSA-N
MW306.45 g/mol
LogP4.25
Rot. Bonds9

About (4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol

(4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol (PubChem CID 10357825) has the molecular formula C22H26O and a molecular weight of 306.45 g/mol. Its IUPAC name is (4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol.

Molecular Properties

Compound Name(4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol
PubChem CID10357825
Molecular FormulaC22H26O
Molecular Weight306.45 g/mol
Exact Mass306.20
IUPAC Name(4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol
SMILESC#C/C=C\CCCCCCC#CC#CCCC/C=C\C#CCO
InChIInChI=1S/C22H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h1,3-4,18-19,23H,5-10,15-17,22H2/b4-3-,19-18-
InChIKeyQZOMSTWCVSLZGH-WLXZLGQWSA-N
XLogP4.25
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.45
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol?
The IUPAC name of (4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol (CID 10357825) is (4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol.
What is the SMILES notation for (4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol?
The canonical SMILES for (4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol is C#C/C=C\CCCCCCC#CC#CCCC/C=C\C#CCO.
What is the InChIKey of (4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol?
The InChIKey is QZOMSTWCVSLZGH-WLXZLGQWSA-N. The full InChI is InChI=1S/C22H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h1,3-4,18-19,23H,5-10,15-17,22H2/b4-3-,19-18-.
What are the key properties of (4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol?
(4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol has a molecular weight of 306.45 g/mol, XLogP of 4.25, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z,19Z)-docosa-4,19-dien-2,9,11,21-tetrayn-1-ol is sourced from PubChem (CID 10357825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).