Deacetyl-7-xylosyltaxol C
TL;DR: Deacetyl-7-xylosyltaxol C (CAS 90332-65-3) is a chemical compound with molecular formula C49H63NO17 and molecular weight 937.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-acetyloxy-15-[3-(hexanoylamino)-2-hydroxy-3-phenylpropanoyl]oxy-1,12-dihydroxy-10,14,17,17-tetramethyl-11-oxo-9-(3,4,5-trihydroxyoxan-2-yl)oxy-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
Also Known As: Deacetyl-7-xylosyltaxol C, 7-Xylosyl-10-deacetyltaxol C, 10-DEACETYL-7-XYLOSYLPACLITAXEL, [4-acetoxy-15-[3-(hexanoylamino)-2-hydroxy-3-phenyl-propanoyl]oxy-1,12-dihydroxy-10,14,17,17-tetramethyl-11-oxo-9-(3,4,5-trihydroxytetrahydropyran-2-yl)oxy-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
| Molecular Formula | C49H63NO17 |
|---|---|
| Molecular Weight | 937.41 g/mol |
| LogP | 1.8947 |
| Topological Polar Surface Area | 274.14 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 14 |
| Exact Mass | 937.4096 |
| Heavy Atoms | 67 |
| Complexity | 2202.0535 |
Chemical Identifiers
| CAS Number | 90332-65-3 |
|---|---|
| SMILES | CCCCCC(=O)NC(C1=CC=CC=C1)C(C(=O)OC2CC3(C(C4C(C(CC5C4(CO5)OC(=O)C)OC6C(C(C(CO6)O)O)O)(C(=O)C(C(=C2C)C3(C)C)O)C)OC(=O)C7=CC=CC=C7)O)O |
Product Overview
Deacetyl-7-xylosyltaxol C (CAS 90332-65-3), with molecular formula C49H63NO17 and molecular weight 937.41 g/mol. IUPAC: [4-acetyloxy-15-[3-(hexanoylamino)-2-hydroxy-3-phenylpropanoyl]oxy-1,12-dihydroxy-10,14,17,17-tetramethyl-11-oxo-9-(3,4,5-trihydroxyoxan-2-yl)oxy-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate.
Chemical Property Profile of Deacetyl-7-xylosyltaxol C
Property Insights of Deacetyl-7-xylosyltaxol C
The XLogP value of 1.8947 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Deacetyl-7-xylosyltaxol C. The TPSA of 274.14 Ų indicates high polarity, suggesting Deacetyl-7-xylosyltaxol C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Deacetyl-7-xylosyltaxol C has 7 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Deacetyl-7-xylosyltaxol C?
The CAS number of Deacetyl-7-xylosyltaxol C is 90332-65-3.
What is the molecular formula of Deacetyl-7-xylosyltaxol C?
The molecular formula of Deacetyl-7-xylosyltaxol C is C49H63NO17.
What is the molecular weight of Deacetyl-7-xylosyltaxol C?
The molecular weight of Deacetyl-7-xylosyltaxol C is 937.41 g/mol.
Where can I buy Deacetyl-7-xylosyltaxol C?
You can request a quote for Deacetyl-7-xylosyltaxol C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deacetyl-7-xylosyltaxol C?
Yes, KEHONG BIO provides custom synthesis services for Deacetyl-7-xylosyltaxol C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.