(Z)-8-hydroxytetracos-15-enoic acid

C24H46O3 — CID 161317669

IUPAC(Z)-8-hydroxytetracos-15-enoic acid
SMILESCCCCCCCC/C=C\CCCCCCC(O)CCCCCCC(=O)O
InChIInChI=1S/C24H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-23(25)21-18-15-16-19-22-24(26)27/h9-10,23,25H,2-8,11-22H2,1H3,(H,26,27)/b10-9-
InChIKeyVJSGSWCEIRPEKD-KTKRTIGZSA-N
MW382.63 g/mol
LogP7.42
Rot. Bonds21

About (Z)-8-hydroxytetracos-15-enoic acid

(Z)-8-hydroxytetracos-15-enoic acid (PubChem CID 161317669) has the molecular formula C24H46O3 and a molecular weight of 382.63 g/mol. Its IUPAC name is (Z)-8-hydroxytetracos-15-enoic acid.

Molecular Properties

Compound Name(Z)-8-hydroxytetracos-15-enoic acid
PubChem CID161317669
Molecular FormulaC24H46O3
Molecular Weight382.63 g/mol
Exact Mass382.34
IUPAC Name(Z)-8-hydroxytetracos-15-enoic acid
SMILESCCCCCCCC/C=C\CCCCCCC(O)CCCCCCC(=O)O
InChIInChI=1S/C24H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-23(25)21-18-15-16-19-22-24(26)27/h9-10,23,25H,2-8,11-22H2,1H3,(H,26,27)/b10-9-
InChIKeyVJSGSWCEIRPEKD-KTKRTIGZSA-N
XLogP7.42
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds21
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.63
LogP ≤ 57.42
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'}

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Related Compounds

14-hydroxydotriacont-20-enoic acid
CID 168720018
(Z)-15-hydroxyoctadec-6-enoic acid
CID 87225177
(E)-13-hydroxyhexadec-6-enoic acid
CID 87224864
12-hydroxyicos-14-enoic acid
CID 169277255
(Z)-12-hydroxyoctadec-9-enoic acid
CID 5282942
(Z)-20,21-dihydroxyhenicos-9-enoic acid;(Z)-octadec-9-enoic acid
CID 158902601
12-hydroxyhenicos-14-enoic acid
CID 169277303
(Z)-7-hydroxyoctadec-9-enoic acid
CID 101326222
4-hydroxydocosa-9,13-dienoic acid
CID 139805405
(Z,12R)-12-hydroxyoctadec-9-enoic acid;silver
CID 174840171
CID 131874957
CID 131874957
CID 175884069
CID 175884069

Frequently Asked Questions

What is the IUPAC name of (Z)-8-hydroxytetracos-15-enoic acid?
The IUPAC name of (Z)-8-hydroxytetracos-15-enoic acid (CID 161317669) is (Z)-8-hydroxytetracos-15-enoic acid.
What is the SMILES notation for (Z)-8-hydroxytetracos-15-enoic acid?
The canonical SMILES for (Z)-8-hydroxytetracos-15-enoic acid is CCCCCCCC/C=C\CCCCCCC(O)CCCCCCC(=O)O.
What is the InChIKey of (Z)-8-hydroxytetracos-15-enoic acid?
The InChIKey is VJSGSWCEIRPEKD-KTKRTIGZSA-N. The full InChI is InChI=1S/C24H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-23(25)21-18-15-16-19-22-24(26)27/h9-10,23,25H,2-8,11-22H2,1H3,(H,26,27)/b10-9-.
What are the key properties of (Z)-8-hydroxytetracos-15-enoic acid?
(Z)-8-hydroxytetracos-15-enoic acid has a molecular weight of 382.63 g/mol, XLogP of 7.42, 21 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-8-hydroxytetracos-15-enoic acid is sourced from PubChem (CID 161317669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).