Arthrofactin
TL;DR: Arthrofactin (CAS 152406-36-5) is a chemical compound with molecular formula C64H111N11O20 and molecular weight 1353.8007 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(3S,6S,9S,12R,15S,18R,21R,24R,30R,33R)-6,9-bis[(2S)-butan-2-yl]-3-(carboxymethyl)-37-heptyl-27-[(1S)-1-hydroxyethyl]-12,18-bis(hydroxymethyl)-15,21,24,33-tetrakis(2-methylpropyl)-2,5,8,11,14,17,20,23,26,29,32,35-dodecaoxo-1-oxa-4,7,10,13,16,19,22,25,28,31,34-undecazacycloheptatriacont-30-yl]acetic acid
Also Known As: Arthrofactin, 2-[(3S,6S,9S,12R,15S,18R,21R,24R,30R,33R)-6,9-bis[(2S)-butan-2-yl]-3-(carboxymethyl)-37-heptyl-27-[(1S)-1-hydroxyethyl]-12,18-bis(hydroxymethyl)-15,21,24,33-tetrakis(2-methylpropyl)-2,5,8,11,14,17,20,23,26,29,32,35-dodecaoxo-1-oxa-4,7,10,13,16,19,22,25,28,31,34-undecazacycloheptatriacont-30-yl]acetic acid, 2,2'-((3S,6S,9S,12R,15S,18R,21R,24R,30R,33R)-6,9-di((S)-sec-butyl)-37-heptyl-27-((S)-1-hydroxyethyl)-12,18-bis(hydroxymethyl)-15,21,24,33-tetraisobutyl-2,5,8,11,14,17,20,23,26,29,32,35-dodecaoxo-1-oxa-4,7,10,13,16,19,22,25,28,31,34-undecaazacycloheptatriacontane-3,30-diyl)diacetic acid, L-Aspartic acid, N-(N-(N-(N-(N-(N-(N-(N-(N-(N-(N-(3-hydroxy-1-oxodecyl)-D-leucyl)-D-alpha-aspartyl)-D-threonyl)-D-leucyl)-D-leucyl)-D-seryl)-L-leucyl)-D-seryl)-L-isoleucyl)-L-isoleucyl)-, lambda1-lactone
Technical Specifications
| Molecular Formula | C64H111N11O20 |
| Molecular Weight | 1353.8007 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 482.0 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 25 |
| Exact Mass | 1353.8007 Da |
| Heavy Atoms | 95 |
| Complexity | 2570.0 |
| SMILES | CCCCCCCC1CC(=O)N[C@@H](C(=O)N[C@@H](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@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O1)CC(=O)O)[C@@H](C)CC)[C@@H](C)CC)CO)CC(C)C)CO)CC(C)C)CC(C)C)[C@H](C)O)CC(=O)O)CC(C)C |
| InChIKey | HXMCERBOSXQYRH-PUWFPHIESA-N |
Chemical Property Profile of Arthrofactin
Property Insights of Arthrofactin
The XLogP value of 5.6 indicates that Arthrofactin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 482.0 Ų indicates high polarity, suggesting Arthrofactin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Arthrofactin has 16 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Arthrofactin?
The CAS number of Arthrofactin is 152406-36-5.
What is the molecular formula of Arthrofactin?
The molecular formula of Arthrofactin is C64H111N11O20.
What is the molecular weight of Arthrofactin?
The molecular weight of Arthrofactin is 1353.8007 g/mol.
Where can I buy Arthrofactin?
You can request a quote for Arthrofactin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Arthrofactin?
Yes, CoreyChem provides custom synthesis services for Arthrofactin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.