4,4-dimethylcholesta-8,14-dien-3-ol

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 149
Total Number of Articles : 132
PubChem 167817
Molecular Formula

C29H48O

SMILES

C[C@H](CCCC(C)C)[C@H]1CC=C2[C@@]1(CCC3=C2CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)C

InChI

InChI=1S/C29H48O/c1-19(2)9-8-10-20(3)22-12-13-23-21-11-14-25-27(4,5)26(30)16-18-29(25,7)24(21)15-17-28(22,23)6/h13,19-20,22,25-26,30H,8-12,14-18H2,1-7H3/t20-,22-,25+,26+,28-,29-/m1/s1

synonyms
  • 19456-83-8
  • 4,4-dimethyl-5alpha-cholesta-8,14-dien-3beta-ol
  • 4,4-Dimethylcholesta-8,14-dien-3-ol
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Properties
Property Value
MW 412.7 g/mol
HBD 1
HBA 1
Rotatable Bond Count 5
Exact Mass 412.370516150 g/mol
Monoisotopic Mass 412.370516150 g/mol
Heavy Atom Count 30
Isotope Atom Count 0
Atom Stereo Count 6
Covalent Unit Count 1
Complexity 725
xlogp 8.2
Topological Polar Surface Area 20.2