Antibiotic C 33196E5R
TL;DR: Antibiotic C 33196E5R (CAS 86683-20-7) is a chemical compound with molecular formula C29H42N2O8 and molecular weight 546.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4E,6E,10E)-14,20,22-trihydroxy-13,17-dimethoxy-4,8,10,12,16-pentamethyl-3-oxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18(22),19-hexaen-9-yl] carbamate
Also Known As: Antibiotic C 33196E5R, C 33196E5R, Geldanamycin, 18,21-didehydro-6,17-didemethoxy-12-O-demethyl-1,8,21-dideoxo-18,21-dihydroxy-15-methoxy-6-methyl-11-O-methyl-, (6S,15R)-, [(8E,12E,14E)-5,20,22-trihydroxy-2,6-dimethoxy-3,7,9,11,15-pentamethyl-16-oxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18(22),19-hexaen-10-yl] carbamate
| Molecular Formula | C29H42N2O8 |
|---|---|
| Molecular Weight | 546.29 g/mol |
| LogP | 4.3244 |
| Topological Polar Surface Area | 160.57 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 546.2941 |
| Heavy Atoms | 39 |
| Complexity | 1112.7499 |
Chemical Identifiers
| CAS Number | 86683-20-7 |
|---|---|
| SMILES | CC1CC(C(C(/C=C(/C(C(/C=C/C=C(/C(=O)NC2=CC(=CC(=C2O)C1OC)O)\C)C)OC(=O)N)\C)C)OC)O |
Product Overview
Antibiotic C 33196E5R (CAS 86683-20-7), with molecular formula C29H42N2O8 and molecular weight 546.29 g/mol. IUPAC: [(4E,6E,10E)-14,20,22-trihydroxy-13,17-dimethoxy-4,8,10,12,16-pentamethyl-3-oxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18(22),19-hexaen-9-yl] carbamate.
Chemical Property Profile of Antibiotic C 33196E5R
Property Insights of Antibiotic C 33196E5R
The XLogP value of 4.3244 indicates that Antibiotic C 33196E5R is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 160.57 Ų indicates high polarity, suggesting Antibiotic C 33196E5R may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Antibiotic C 33196E5R has 5 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 Antibiotic C 33196E5R?
The CAS number of Antibiotic C 33196E5R is 86683-20-7.
What is the molecular formula of Antibiotic C 33196E5R?
The molecular formula of Antibiotic C 33196E5R is C29H42N2O8.
What is the molecular weight of Antibiotic C 33196E5R?
The molecular weight of Antibiotic C 33196E5R is 546.29 g/mol.
Where can I buy Antibiotic C 33196E5R?
You can request a quote for Antibiotic C 33196E5R directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Antibiotic C 33196E5R?
Yes, KEHONG BIO provides custom synthesis services for Antibiotic C 33196E5R and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.