Clitorin
TL;DR: Clitorin (CAS 55804-74-5) is a chemical compound with molecular formula C33H40O19 and molecular weight 740.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4,5-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
Also Known As: Clitorin, Mauritianin, clitorin [M+H]+, Compound NP-007198, MEGxp0_001432
| Molecular Formula | C33H40O19 |
|---|---|
| Molecular Weight | 740.22 g/mol |
| LogP | -2.5409 |
| Topological Polar Surface Area | 308.12 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 8 |
| Exact Mass | 740.2164 |
| Heavy Atoms | 52 |
| Complexity | 1764.666 |
Chemical Identifiers
| CAS Number | 55804-74-5 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)OC6C(C(C(C(O6)C)O)O)O)O)O)O)O)O |
Product Overview
Clitorin (CAS 55804-74-5), with molecular formula C33H40O19 and molecular weight 740.22 g/mol. IUPAC: 3-[4,5-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one.
Chemical Property Profile of Clitorin
Property Insights of Clitorin
The XLogP value of -2.5409 indicates that Clitorin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 308.12 Ų indicates high polarity, suggesting Clitorin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Clitorin has 11 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Clitorin?
The CAS number of Clitorin is 55804-74-5.
What is the molecular formula of Clitorin?
The molecular formula of Clitorin is C33H40O19.
What is the molecular weight of Clitorin?
The molecular weight of Clitorin is 740.22 g/mol.
Where can I buy Clitorin?
You can request a quote for Clitorin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clitorin?
Yes, KEHONG BIO provides custom synthesis services for Clitorin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.