Ubisemiquinone
TL;DR: Ubisemiquinone (CAS 27696-12-4) is a chemical compound with molecular formula C59H90O4 and molecular weight 862.68 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2E,6E,10E,14E,18E,22E,26Z,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-methylcyclohexa-2,5-diene-1,4-dione
Also Known As: ubisemiquinone, Coenzyme Q10, 2,3-dimethoxy-5-methyl-6-decaprenylbenzoquinone, 2-[(2E,6E,10E,14E,18E,22E,26Z,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-methylcyclohexa-2,5-diene-1,4-dione, 2-((2E,6E,10E,14E,18E,22E,26Z,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-methylcyclohexa-2,5-diene-1,4-dione
| Molecular Formula | C59H90O4 |
|---|---|
| Molecular Weight | 862.68 g/mol |
| LogP | 17.8539 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 31 |
| Exact Mass | 862.6839 |
| Heavy Atoms | 63 |
| Complexity | 1844.2329 |
Chemical Identifiers
| CAS Number | 27696-12-4 |
|---|---|
| SMILES | CC1=C(C(=O)C(=C(C1=O)OC)OC)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 |
Product Overview
Ubisemiquinone (CAS 27696-12-4), with molecular formula C59H90O4 and molecular weight 862.68 g/mol. IUPAC: 2-[(2E,6E,10E,14E,18E,22E,26Z,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-methylcyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of Ubisemiquinone
Property Insights of Ubisemiquinone
The XLogP value of 17.8539 indicates that Ubisemiquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Ubisemiquinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ubisemiquinone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ubisemiquinone?
The CAS number of Ubisemiquinone is 27696-12-4.
What is the molecular formula of Ubisemiquinone?
The molecular formula of Ubisemiquinone is C59H90O4.
What is the molecular weight of Ubisemiquinone?
The molecular weight of Ubisemiquinone is 862.68 g/mol.
Where can I buy Ubisemiquinone?
You can request a quote for Ubisemiquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ubisemiquinone?
Yes, KEHONG BIO provides custom synthesis services for Ubisemiquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.