Structure database (LMSD)

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LM IDLMPR02010005
Common NameCoenzyme Q8
Systematic Name-
Synonyms-
Exact Mass
726.5587 (neutral)    Calculate m/z:
FormulaC49H74O4
CategoryPrenol Lipids [PR]
Main ClassQuinones and hydroquinones [PR02]
Sub ClassUbiquinones [PR0201]
LIPIDBANK IDVCQ0005
PubChem Substance ID (SID)7850616
METABOLOMICS ID-
KEGG IDC00399
HMDB IDHMDB06709
YMDB ID-
CHEBI ID16389
InChIKeyICFIZJQGJAJRSU-SGHXUWJISA-N  Show lipids differing only in stereochemistry/bond geometry
InChI1S/C49H74O4/c1-36(2)20-13-21-37(3)22-14-23-38(4)24-15-25-39(5)26-16-27-40(6)28-1
7-29-41(7)30-18-31-42(8)32-19-33-43(9)34-35-45-44(10)46(50)48(52-11)49(53-12)47(
45)51/h20,22,24,26,28,30,32,34H,13-19,21,23,25,27,29,31,33,35H2,1-12H3/b37-22+,3
8-24+,39-26+,40-28+,41-30+,42-32+,43-34+
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms53Rings1Aromatic Rings0Rotatable Bonds25
 van der Waals
Molecular Volume		847.38Topological Polar
Surface Area		52.60Hydrogen
Bond Donors		0Hydrogen
Bond Acceptors		4
 logP14.40Molar
Refractivity		228.74    
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