(7Z,11Z)-octadeca-7,11-diene-1,18-diol

C18H34O2 — CID 171904791

IUPAC(7Z,11Z)-octadeca-7,11-diene-1,18-diol
SMILESOCCCCCC/C=C\CC/C=C\CCCCCCO
InChIInChI=1S/C18H34O2/c19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20/h3-6,19-20H,1-2,7-18H2/b5-3-,6-4-
InChIKeyXKJXFUACTBSHJU-GLIMQPGKSA-N
MW282.47 g/mol
LogP4.76
Rot. Bonds15

About (7Z,11Z)-octadeca-7,11-diene-1,18-diol

(7Z,11Z)-octadeca-7,11-diene-1,18-diol (PubChem CID 171904791) has the molecular formula C18H34O2 and a molecular weight of 282.47 g/mol. Its IUPAC name is (7Z,11Z)-octadeca-7,11-diene-1,18-diol.

Molecular Properties

Compound Name(7Z,11Z)-octadeca-7,11-diene-1,18-diol
PubChem CID171904791
Molecular FormulaC18H34O2
Molecular Weight282.47 g/mol
Exact Mass282.26
IUPAC Name(7Z,11Z)-octadeca-7,11-diene-1,18-diol
SMILESOCCCCCC/C=C\CC/C=C\CCCCCCO
InChIInChI=1S/C18H34O2/c19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20/h3-6,19-20H,1-2,7-18H2/b5-3-,6-4-
InChIKeyXKJXFUACTBSHJU-GLIMQPGKSA-N
XLogP4.76
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 54.76
H-Bond Donors ≤ 52
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 (7Z,11Z)-octadeca-7,11-diene-1,18-diol 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

hexadec-8-ene-1,16-diol
CID 54395986
(E)-hexadec-1-ene-1,16-diol
CID 57427575
heptadec-1-ene-1,17-diol
CID 142730253
(E)-undec-8-en-1-ol
CID 6366560
(E)-docos-9-en-1-ol
CID 23502502
(E)-heptadec-7-en-1-ol
CID 19790013
(5Z,11Z)-icosa-5,11-dien-1-ol
CID 51353972
(Z)-undec-7-en-1-ol
CID 93484782
[(E)-11-hydroxyundec-1-enyl]boronic acid
CID 10987620
henicos-10-en-1-ol
CID 86069169
(Z)-octadec-7-en-1-ol
CID 13338918
(E)-heptadec-12-en-1-ol
CID 87814318

Frequently Asked Questions

What is the IUPAC name of (7Z,11Z)-octadeca-7,11-diene-1,18-diol?
The IUPAC name of (7Z,11Z)-octadeca-7,11-diene-1,18-diol (CID 171904791) is (7Z,11Z)-octadeca-7,11-diene-1,18-diol.
What is the SMILES notation for (7Z,11Z)-octadeca-7,11-diene-1,18-diol?
The canonical SMILES for (7Z,11Z)-octadeca-7,11-diene-1,18-diol is OCCCCCC/C=C\CC/C=C\CCCCCCO.
What is the InChIKey of (7Z,11Z)-octadeca-7,11-diene-1,18-diol?
The InChIKey is XKJXFUACTBSHJU-GLIMQPGKSA-N. The full InChI is InChI=1S/C18H34O2/c19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20/h3-6,19-20H,1-2,7-18H2/b5-3-,6-4-.
What are the key properties of (7Z,11Z)-octadeca-7,11-diene-1,18-diol?
(7Z,11Z)-octadeca-7,11-diene-1,18-diol has a molecular weight of 282.47 g/mol, XLogP of 4.76, 15 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7Z,11Z)-octadeca-7,11-diene-1,18-diol is sourced from PubChem (CID 171904791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).