Structure database (LMSD)
Return to Databases Overview

MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

LM ID	LMST01010090
Common Name	Desmosterol(d6)
Systematic Name	cholest-5,24-dien-3β-ol(d6)
Synonyms	-
Exact Mass	390.3763 (neutral) Calculate m/z:
Formula	C₂₇H₃₈D₆O
Category	Sterol Lipids [ST]
Main Class	Sterols [ST01]
Sub Class	Cholesterol and derivatives [ST0101]
PubChem CID	5314026
KEGG ID	C01802
HMDB ID	HMDB02719
CHEBI ID	17737
CAYMAN ID	26777
InChIKey	AVSXSVCZWQODGV-QSOBUISFSA-N Show lipids differing only in stereochemistry/bond geometry
InChI	InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7,9,19,21-25,28H,6,8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1/i1D3,2D3 Click to highlight InChI
SMILES	[C@]12(CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@]([H])([C@@](C)([H])CC/C=C(/C([2H])([2H])[2H])\C([2H])([2H])[2H])CC[C@@]21[H])[H] Click to highlight SMILES
Status	Active (Isotopically labelled standard)
Comments	Synthetic deuterated standard

Structure database (LMSD)Return to Databases Overview