Structure Database (LMSD)
Common Name
14alpha-Methylfecosterol
Systematic Name
14.α-methyl-5α-ergosta-8,24(28)-dien-3β-ol
Synonyms
3D model of 14alpha-Methylfecosterol
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
References
String Representations
InChiKey (Click to copy)
OOSRLXVESAEQCR-GLISWAMPSA-N
InChi (Click to copy)
InChI=1S/C29H48O/c1-19(2)20(3)8-9-21(4)24-13-16-29(7)26-11-10-22-18-23(30)12-15-27(22,5)25(26)14-17-28(24,29)6/h19,21-24,30H,3,8-18H2,1-2,4-7H3/t21-,22+,23+,24-,27+,28-,29+/m1/s1
SMILES (Click to copy)
C1C[C@H](O)C[C@]2([H])CCC3[C@]4(C)CC[C@]([H])([C@H](C)CCC(=C)C(C)C)[C@@]4(C)CCC=3[C@@]12C
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
30
Rings
4
Aromatic Rings
Rotatable Bonds
5
Van der Waals Molecular Volume
464.33
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
8.38
Molar Refractivity
128.77
Admin
Created at
4th Apr 2023
Updated at
4th Apr 2023