16,17-dihydro-17-hydroxyrifamycin S
TL;DR: 16,17-dihydro-17-hydroxyrifamycin S (CAS 82534-57-4) is a chemical compound with molecular formula C37H47NO13 and molecular weight 713.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(9E,19E)-2,15,17,21-tetrahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23,27,29-tetraoxo-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(28),2,4,9,19,25-hexaen-13-yl] acetate
Also Known As: 16,17-Di-HY-rifamycin S, 16,17-Dihydro-17-hydroxyrifamycin S, Rifamycin, 1,4-dideoxy-1,4,16,17-tetrahydro-17-hydroxy-1,4-dioxo-, [(9E,19E)-2,15,17,21-tetrahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23,27,29-tetraoxo-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(28),2,4,9,19,25-hexaen-13-yl] acetate, RefChem:78935
| Molecular Formula | C37H47NO13 |
|---|---|
| Molecular Weight | 713.30 g/mol |
| LogP | 2.68102 |
| Topological Polar Surface Area | 215.22 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 2 |
| Exact Mass | 713.30475 |
| Heavy Atoms | 51 |
| Complexity | 1694.9655 |
Chemical Identifiers
| CAS Number | 82534-57-4 |
|---|---|
| SMILES | CC1/C=C/C(C(C(=O)NC2=CC(=O)C3=C(C2=O)C(=C(C4=C3C(=O)C(O4)(O/C=C/C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)C)O |
Product Overview
16,17-dihydro-17-hydroxyrifamycin S (CAS 82534-57-4), with molecular formula C37H47NO13 and molecular weight 713.30 g/mol. IUPAC: [(9E,19E)-2,15,17,21-tetrahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23,27,29-tetraoxo-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(28),2,4,9,19,25-hexaen-13-yl] acetate.
Chemical Property Profile of 16,17-dihydro-17-hydroxyrifamycin S
Property Insights of 16,17-dihydro-17-hydroxyrifamycin S
The XLogP value of 2.68102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 16,17-dihydro-17-hydroxyrifamycin S. The TPSA of 215.22 Ų indicates high polarity, suggesting 16,17-dihydro-17-hydroxyrifamycin S may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 16,17-dihydro-17-hydroxyrifamycin S has 5 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 16,17-dihydro-17-hydroxyrifamycin S?
The CAS number of 16,17-dihydro-17-hydroxyrifamycin S is 82534-57-4.
What is the molecular formula of 16,17-dihydro-17-hydroxyrifamycin S?
The molecular formula of 16,17-dihydro-17-hydroxyrifamycin S is C37H47NO13.
What is the molecular weight of 16,17-dihydro-17-hydroxyrifamycin S?
The molecular weight of 16,17-dihydro-17-hydroxyrifamycin S is 713.30 g/mol.
Where can I buy 16,17-dihydro-17-hydroxyrifamycin S?
You can request a quote for 16,17-dihydro-17-hydroxyrifamycin S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 16,17-dihydro-17-hydroxyrifamycin S?
Yes, KEHONG BIO provides custom synthesis services for 16,17-dihydro-17-hydroxyrifamycin S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.