cyclosporine metabolite M17
TL;DR: cyclosporine metabolite M17 (CAS 89270-28-0) is a chemical compound with molecular formula C62H111N11O13 and molecular weight 1217.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6S,9S,12R,15S,18S,30S)-33-[(E,1R,2R)-1,6-dihydroxy-2-methylhex-4-enyl]-30-ethyl-1,4,7,10,12,15,19,25,28-nonamethyl-6,9,18,24-tetrakis(2-methylpropyl)-3,21-di(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacontane-2,5,8,11,14,17,20,23,26,29,32-undecone
Also Known As: Hydroxycyclosporine, Cyclosporin AM 1, Cyclosporin metabolite m17, Cyclosporine metabolite M17, Csa M17
| Molecular Formula | C62H111N11O13 |
|---|---|
| Molecular Weight | 1217.84 g/mol |
| LogP | 2.2414 |
| Topological Polar Surface Area | 299.03 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 16 |
| Exact Mass | 1217.8363 |
| Heavy Atoms | 86 |
| Complexity | 2345.3337 |
Chemical Identifiers
| CAS Number | 89270-28-0 |
|---|---|
| SMILES | CC[C@H]1C(=O)N(CC(=O)N(C(C(=O)NC(C(=O)N([C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N(C(C(=O)N(C(C(=O)N1)[C@@H]([C@H](C)C/C=C/CO)O)C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)C(C)C)CC(C)C)C)C |
Product Overview
cyclosporine metabolite M17 (CAS 89270-28-0), with molecular formula C62H111N11O13 and molecular weight 1217.84 g/mol. IUPAC: (6S,9S,12R,15S,18S,30S)-33-[(E,1R,2R)-1,6-dihydroxy-2-methylhex-4-enyl]-30-ethyl-1,4,7,10,12,15,19,25,28-nonamethyl-6,9,18,24-tetrakis(2-methylpropyl)-3,21-di(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacontane-2,5,8,11,14,17,20,23,26,29,32-undecone.
Chemical Property Profile of cyclosporine metabolite M17
Property Insights of cyclosporine metabolite M17
The XLogP value of 2.2414 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cyclosporine metabolite M17. The TPSA of 299.03 Ų indicates high polarity, suggesting cyclosporine metabolite M17 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, cyclosporine metabolite M17 has 6 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 cyclosporine metabolite M17?
The CAS number of cyclosporine metabolite M17 is 89270-28-0.
What is the molecular formula of cyclosporine metabolite M17?
The molecular formula of cyclosporine metabolite M17 is C62H111N11O13.
What is the molecular weight of cyclosporine metabolite M17?
The molecular weight of cyclosporine metabolite M17 is 1217.84 g/mol.
Where can I buy cyclosporine metabolite M17?
You can request a quote for cyclosporine metabolite M17 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cyclosporine metabolite M17?
Yes, KEHONG BIO provides custom synthesis services for cyclosporine metabolite M17 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.