Bivittoside D
TL;DR: Bivittoside D (CAS 77394-06-0) is a chemical compound with molecular formula C67H110O32 and molecular weight 1426.70 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-[5-[4-[3,5-dihydroxy-6-(hydroxymethyl)-4-methoxyoxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[5-[4-[3,5-dihydroxy-6-(hydroxymethyl)-4-methoxyoxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxyoxan-2-yl]oxy-10-hydroxy-2,6,13,17,17-pentamethyl-6-(4-methylpentyl)-7-oxapentacyclo[10.8.0.02,9.05,9.013,18]icos-11-en-8-one
Also Known As: Bivittoside D, Bohadschioside A
| Molecular Formula | C67H110O32 |
|---|---|
| Molecular Weight | 1426.70 g/mol |
| LogP | -1.7 |
| Topological Polar Surface Area | 479.0 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 32 |
| Rotatable Bonds | 22 |
| Exact Mass | 1426.698 |
| Heavy Atoms | 99 |
| Complexity | 2740.0 |
Chemical Identifiers
| CAS Number | 77394-06-0 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)C)CCC5C4=CC(C67C5(CCC6C(OC7=O)(C)CCCC(C)C)C)O)C)OC8C(C(C(C(O8)CO)O)OC9C(C(C(C(O9)CO)O)OC)O)O)O)O)O)OC1C(C(C(C(O1)CO)O)OC1C(C(C(C(O1)CO)O)OC)O)O |
| InChIKey | QJXYVWRUWRZFBA-UHFFFAOYSA-N |
Product Overview
Bivittoside D (CAS 77394-06-0), with molecular formula C67H110O32 and molecular weight 1426.70 g/mol. IUPAC: 16-[5-[4-[3,5-dihydroxy-6-(hydroxymethyl)-4-methoxyoxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[5-[4-[3,5-dihydroxy-6-(hydroxymethyl)-4-methoxyoxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxyoxan-2-yl]oxy-10-hydroxy-2,6,13,17,17-pentamethyl-6-(4-methylpentyl)-7-oxapentacyclo[10.8.0.02,9.05,9.013,18]icos-11-en-8-one.
Chemical Property Profile of Bivittoside D
Property Insights of Bivittoside D
The XLogP value of -1.7 indicates that Bivittoside D is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 479.0 Ų indicates high polarity, suggesting Bivittoside D may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bivittoside D has 16 hydrogen bond donor(s) and 32 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bivittoside D?
The CAS number of Bivittoside D is 77394-06-0.
What is the molecular formula of Bivittoside D?
The molecular formula of Bivittoside D is C67H110O32.
What is the molecular weight of Bivittoside D?
The molecular weight of Bivittoside D is 1426.70 g/mol.
Where can I buy Bivittoside D?
You can request a quote for Bivittoside D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bivittoside D?
Yes, KEHONG BIO provides custom synthesis services for Bivittoside D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.