(4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol

C30H42O — CID 46846122

IUPAC(4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol
SMILESCC(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C=C(C)/C=C/CC(C)(C)O
InChIInChI=1S/C30H42O/c1-25(2)15-11-18-26(3)16-9-10-17-27(4)19-12-20-28(5)21-13-22-29(6)23-14-24-30(7,8)31/h9-23,31H,24H2,1-8H3/b10-9+,18-11+,19-12+,21-13+,23-14+,26-16+,27-17+,28-20+,29-22+
InChIKeyFOIFOTKOVLXQJE-GOWUZQRBSA-N
MW418.67 g/mol
LogP8.68
Rot. Bonds11

About (4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol

(4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol (PubChem CID 46846122) has the molecular formula C30H42O and a molecular weight of 418.67 g/mol. Its IUPAC name is (4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol.

Molecular Properties

Compound Name(4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol
PubChem CID46846122
Molecular FormulaC30H42O
Molecular Weight418.67 g/mol
Exact Mass418.32
IUPAC Name(4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol
SMILESCC(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C=C(C)/C=C/CC(C)(C)O
InChIInChI=1S/C30H42O/c1-25(2)15-11-18-26(3)16-9-10-17-27(4)19-12-20-28(5)21-13-22-29(6)23-14-24-30(7,8)31/h9-23,31H,24H2,1-8H3/b10-9+,18-11+,19-12+,21-13+,23-14+,26-16+,27-17+,28-20+,29-22+
InChIKeyFOIFOTKOVLXQJE-GOWUZQRBSA-N
XLogP8.68
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.67
LogP ≤ 58.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of (4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol?
The IUPAC name of (4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol (CID 46846122) is (4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol.
What is the SMILES notation for (4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol?
The canonical SMILES for (4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol is CC(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C=C(C)/C=C/CC(C)(C)O.
What is the InChIKey of (4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol?
The InChIKey is FOIFOTKOVLXQJE-GOWUZQRBSA-N. The full InChI is InChI=1S/C30H42O/c1-25(2)15-11-18-26(3)16-9-10-17-27(4)19-12-20-28(5)21-13-22-29(6)23-14-24-30(7,8)31/h9-23,31H,24H2,1-8H3/b10-9+,18-11+,19-12+,21-13+,23-14+,26-16+,27-17+,28-20+,29-22+.
What are the key properties of (4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol?
(4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol has a molecular weight of 418.67 g/mol, XLogP of 8.68, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,14,19,23-hexamethyltetracosa-4,6,8,10,12,14,16,18,20,22-decaen-2-ol is sourced from PubChem (CID 46846122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).