Structure Database (LMSD)

OH
Common Name
11-cis-Retinol
Systematic Name
11Z-retinol
Synonyms
LM ID
LMPR01090005
Formula
C20H30O
Exact Mass
Calculate m/z
286.229665
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Prenol Lipids [PR]
Isoprenoids [PR01]
Retinoids [PR0109]

String Representations

InChiKey (Click to copy)
FPIPGXGPPPQFEQ-IOUUIBBYSA-N
InChi (Click to copy)
InChI=1S/C20H30O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,21H,7,10,14-15H2,1-5H3/b9-6-,12-11+,16-8+,17-13+
SMILES (Click to copy)
C1(/C=C/C(/C)=C/C=C\C(\C)=C\CO)=C(C)CCCC1(C)C

References

Other Databases

KEGG ID
C00899
HMDB ID
HMDB0006216
CHEBI ID
16302
PubChem CID
5280382
SwissLipids ID
SLM:000000983
Cayman ID
33207
GuidePharm ID
6670

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 1
Aromatic Rings 0
Rotatable Bonds 5
Van der Waals Molecular Volume 337.79
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 5.80
Molar Refractivity 93.70

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Updated at
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