Structure Database (LMSD)
Common Name
Lophenol
Systematic Name
4α-methyl-cholest-7-en-3β-ol
Synonyms
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
LMYZQUNLYGJIHI-SPONXPENSA-N
InChi (Click to copy)
InChI=1S/C28H48O/c1-18(2)8-7-9-19(3)22-12-13-24-21-10-11-23-20(4)26(29)15-17-28(23,6)25(21)14-16-27(22,24)5/h10,18-20,22-26,29H,7-9,11-17H2,1-6H3/t19-,20+,22-,23+,24+,25+,26+,27-,28+/m1/s1
SMILES (Click to copy)
C1[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@]([H])(C)CCCC(C)C)CC[C@@]4([H])C3=CC[C@@]2([H])[C@H](C)[C@@H](O)C1
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Lophocereus schottii
(#153875)
Magnoliopsida
(#3398)
The Neutral Constituents of the Cactus Lophocereus schottii. The Structure of Lophenol--4α-Methyl-Δ7-cholesten-3β-ol--A Link in Sterol Biogenesis,
J Am Chem Soc, 1958
J Am Chem Soc, 1958
DOI:
10.1021/ja01556a031
Other Databases
KEGG ID
HMDB ID
CHEBI ID
LIPIDBANK ID
SST9076
PubChem CID
SwissLipids ID
Calculated Physicochemical Properties
Heavy Atoms
29
Rings
4
Aromatic Rings
0
Rotatable Bonds
5
Van der Waals Molecular Volume
449.67
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
7.92
Molar Refractivity
124.11
Admin
Created at
-
Updated at
25th Jan 2022