Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMST01010087
Common Name24,25-dihydrolanosterol
Systematic Name5α-lanost-8-en-3β-ol
Synonyms24-dihydrolanosterol
Exact Mass
428.4018 (neutral)    Calculate m/z:
FormulaC30H52O
CategorySterol Lipids [ST]
Main ClassSterols [ST01]
Sub ClassCholesterol and derivatives [ST0101]
LIPIDBANK IDSST9114
PubChem CID440560
KEGG IDC05109
HMDB IDHMDB0006839
CHEBI ID28113
SWISSLIPIDS IDSLM:000000467
InChIKeyMBZYKEVPFYHDOH-BQNIITSRSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C30H52O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-
17-28(25,6)23(24)15-19-29(22,30)7/h20-22,25-26,31H,9-19H2,1-8H3/t21-,22-,25+,26+
,28-,29-,30+/m1/s1
SMILESC1[C@]2(C)C3CC[C@]4(C)[C@@]([H])([C@]([H])(C)CCCC(C)C)CC[C@@]4(C)C=3CC[C@@]2([H]
)C(C)(C)[C@@H](O)C1
MS SpectraView MoNA MS spectra     
MS StandardView lipid standard
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms31Rings4Aromatic Rings0Rotatable Bonds5
 van der Waals
Molecular Volume
484.27Topological Polar
Surface Area
20.23Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
1
 logP8.85Molar
Refractivity
133.42