(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol

C20H34O — CID 10891603

IUPAC(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCO
InChIInChI=1S/C20H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h6-7,9-10,12-13,15-16,21H,2-5,8,11,14,17-20H2,1H3/b7-6-,10-9-,13-12-,16-15-
InChIKeyNYBCZSBDKXGAGM-DOFZRALJSA-N
MW290.49 g/mol
LogP6.12
Rot. Bonds14

About (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol

(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol (PubChem CID 10891603) has the molecular formula C20H34O and a molecular weight of 290.49 g/mol. Its IUPAC name is (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol.

Molecular Properties

Compound Name(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol
PubChem CID10891603
Molecular FormulaC20H34O
Molecular Weight290.49 g/mol
Exact Mass290.26
IUPAC Name(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCO
InChIInChI=1S/C20H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h6-7,9-10,12-13,15-16,21H,2-5,8,11,14,17-20H2,1H3/b7-6-,10-9-,13-12-,16-15-
InChIKeyNYBCZSBDKXGAGM-DOFZRALJSA-N
XLogP6.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.49
LogP ≤ 56.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol?
The IUPAC name of (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol (CID 10891603) is (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol.
What is the SMILES notation for (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol?
The canonical SMILES for (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol is CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCO.
What is the InChIKey of (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol?
The InChIKey is NYBCZSBDKXGAGM-DOFZRALJSA-N. The full InChI is InChI=1S/C20H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h6-7,9-10,12-13,15-16,21H,2-5,8,11,14,17-20H2,1H3/b7-6-,10-9-,13-12-,16-15-.
What are the key properties of (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol?
(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol has a molecular weight of 290.49 g/mol, XLogP of 6.12, 14 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraen-1-ol is sourced from PubChem (CID 10891603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).