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Ubiquinol

CAT: 1596-AR-C05585-02Size: 100 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-C05585-02Size:100 Units
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CAS Number
992-78-9
Synonyms
2- ((2E,6E,10E,14E,18E,22E,26E,30E,34E) -3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl) -5,6-dimethoxy-3-methylbenzene-1,4-diol
Molecular Formula
C59H92O4
Molecular Weight
865.38
API Name
Coenzyme

Chemical Information

Ubiquinol

Ubiquinol-10 is a ubiquinol in which the polyprenyl substituent is decaprenyl. It has a role as a metabolite and a biomarker. It is an ubiquinol and a polyprenylhydroquinone.

CAS Number992-78-9
PubChem CID9962735
IUPAC Name2-[(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl]-5,6-dimethoxy-3-methylbenzene-1,4-diol
Molecular FormulaC59H92O4
Molecular Weight865.4
XLogP20.2
Topological Polar Surface Area58.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count31
Heavy Atom Count63
Formal Charge0
Complexity1600
SMILES
CC1=C(C(=C(C(=C1O)OC)OC)O)C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C
InChI
InChI=1S/C59H92O4/c1-44(2)24-15-25-45(3)26-16-27-46(4)28-17-29-47(5)30-18-31-48(6)32-19-33-49(7)34-20-35-50(8)36-21-37-51(9)38-22-39-52(10)40-23-41-53(11)42-43-55-54(12)56(60)58(62-13)59(63-14)57(55)61/h24,26,28,30,32,34,36,38,40,42,60-61H,15-23,25,27,29,31,33,35,37,39,41,43H2,1-14H3/b45-26+,46-28+,47-30+,48-32+,49-34+,50-36+,51-38+,52-40+,53-42+
InChIKey
QNTNKSLOFHEFPK-UPTCCGCDSA-N
Chemical Structure
2D Structure
2D structure of Ubiquinol
CAS: 992-78-9
CID: 9962735
Formula: C59H92O4
MW: 865.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight865.4
XLogP320.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count31
Exact Mass864.69956141
Monoisotopic Mass864.69956141
Topological Polar Surface Area58.9 Ų
Heavy Atom Count63
Formal Charge0
Complexity1600
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count9
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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