Monoanilinogossypol
TL;DR: Monoanilinogossypol (CAS 82085-03-8) is a chemical compound with molecular formula C36H35NO7 and molecular weight 593.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,8-trihydroxy-6-methyl-4-propan-2-yl-7-[1,6,7-trihydroxy-3-methyl-8-(phenyliminomethyl)-5-propan-2-ylnaphthalen-2-yl]naphthalene-1-carbaldehyde
Also Known As: Monoanilinogossypol, monoanilino-gossypol, (2,2'-Binaphthalene)-8-carboxaldehyde, 1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-8'-((phenylimino)methyl)-, 2,3,8-trihydroxy-6-methyl-4-propan-2-yl-7-[1,6,7-trihydroxy-3-methyl-8-(phenyliminomethyl)-5-propan-2-ylnaphthalen-2-yl]naphthalene-1-carbaldehyde, 7-[(8Z)-8-(anilinomethylidene)-1,6-dihydroxy-3-methyl-7-oxo-5-propan-2-ylnaphthalen-2-yl]-2,3,8-trihydroxy-6-methyl-4-propan-2-ylnaphthalene-1-carbaldehyde
| Molecular Formula | C36H35NO7 |
|---|---|
| Molecular Weight | 593.24 g/mol |
| LogP | 8.2 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 593.24133 |
| Heavy Atoms | 44 |
| Complexity | 999.0 |
Chemical Identifiers
| CAS Number | 82085-03-8 |
|---|---|
| SMILES | CC1=CC2=C(C(=C(C(=C2C(C)C)O)O)C=NC3=CC=CC=C3)C(=C1C4=C(C5=C(C=C4C)C(=C(C(=C5C=O)O)O)C(C)C)O)O |
| InChIKey | LXESRBFDJFLHML-UHFFFAOYSA-N |
Product Overview
Monoanilinogossypol (CAS 82085-03-8), with molecular formula C36H35NO7 and molecular weight 593.24 g/mol. IUPAC: 2,3,8-trihydroxy-6-methyl-4-propan-2-yl-7-[1,6,7-trihydroxy-3-methyl-8-(phenyliminomethyl)-5-propan-2-ylnaphthalen-2-yl]naphthalene-1-carbaldehyde.
Chemical Property Profile of Monoanilinogossypol
Property Insights of Monoanilinogossypol
The XLogP value of 8.2 indicates that Monoanilinogossypol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 151.0 Ų indicates high polarity, suggesting Monoanilinogossypol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Monoanilinogossypol has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Monoanilinogossypol?
The CAS number of Monoanilinogossypol is 82085-03-8.
What is the molecular formula of Monoanilinogossypol?
The molecular formula of Monoanilinogossypol is C36H35NO7.
What is the molecular weight of Monoanilinogossypol?
The molecular weight of Monoanilinogossypol is 593.24 g/mol.
Where can I buy Monoanilinogossypol?
You can request a quote for Monoanilinogossypol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Monoanilinogossypol?
Yes, KEHONG BIO provides custom synthesis services for Monoanilinogossypol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.