Biochanin A 7-O-B-D-gentiobioside
TL;DR: Biochanin A 7-O-B-D-gentiobioside (CAS 63770-90-1) is a chemical compound with molecular formula C28H32O15 and molecular weight 608.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-3-(4-methoxyphenyl)-7-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
Also Known As: BIOCHANIN A 7-O-B-D-GENTIOBIOSIDE, 5-Hydroxy-3-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 6-O-hexopyranosylhexopyranoside, 5-hydroxy-3-(4-methoxyphenyl)-7-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
| Molecular Formula | C28H32O15 |
|---|---|
| Molecular Weight | 608.17 g/mol |
| LogP | -1.8229 |
| Topological Polar Surface Area | 238.2 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 8 |
| Exact Mass | 608.17413 |
| Heavy Atoms | 43 |
| Complexity | 1457.0292 |
Chemical Identifiers
| CAS Number | 63770-90-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)O)OC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O |
Product Overview
Biochanin A 7-O-B-D-gentiobioside (CAS 63770-90-1), with molecular formula C28H32O15 and molecular weight 608.17 g/mol. IUPAC: 5-hydroxy-3-(4-methoxyphenyl)-7-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one.
Chemical Property Profile of Biochanin A 7-O-B-D-gentiobioside
Property Insights of Biochanin A 7-O-B-D-gentiobioside
The XLogP value of -1.8229 indicates that Biochanin A 7-O-B-D-gentiobioside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 238.2 Ų indicates high polarity, suggesting Biochanin A 7-O-B-D-gentiobioside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Biochanin A 7-O-B-D-gentiobioside has 8 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Biochanin A 7-O-B-D-gentiobioside?
The CAS number of Biochanin A 7-O-B-D-gentiobioside is 63770-90-1.
What is the molecular formula of Biochanin A 7-O-B-D-gentiobioside?
The molecular formula of Biochanin A 7-O-B-D-gentiobioside is C28H32O15.
What is the molecular weight of Biochanin A 7-O-B-D-gentiobioside?
The molecular weight of Biochanin A 7-O-B-D-gentiobioside is 608.17 g/mol.
Where can I buy Biochanin A 7-O-B-D-gentiobioside?
You can request a quote for Biochanin A 7-O-B-D-gentiobioside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Biochanin A 7-O-B-D-gentiobioside?
Yes, KEHONG BIO provides custom synthesis services for Biochanin A 7-O-B-D-gentiobioside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.