oscillapeptin G
TL;DR: oscillapeptin G (CAS 172548-91-3) is a chemical compound with molecular formula C53H77N9O17 and molecular weight 1111.54 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2S,5S,8S,11R,12S,15S,18R,21R)-8-[(2R)-butan-2-yl]-21-hydroxy-2-[(1R)-1-hydroxyethyl]-5-[(4-hydroxyphenyl)methyl]-4,11-dimethyl-15-(2-methylpropyl)-3,6,9,13,16,22-hexaoxo-10-oxa-1,4,7,14,17-pentazabicyclo[16.3.1]docosan-12-yl]-2-[[(2S)-2-[[(2R)-2,3-dihydroxypropanoyl]amino]-4-(4-hydroxyphenyl)butanoyl]amino]pentanediamide
Also Known As: oscillapeptin G, N-[(2S,5S,8S,11R,12S,15S,18R,21R)-8-[(2R)-butan-2-yl]-21-hydroxy-2-[(1R)-1-hydroxyethyl]-5-[(4-hydroxyphenyl)methyl]-4,11-dimethyl-15-(2-methylpropyl)-3,6,9,13,16,22-hexaoxo-10-oxa-1,4,7,14,17-pentazabicyclo[16.3.1]docosan-12-yl]-2-[[(2S)-2-[[(2R)-2,3-dihydroxypropanoyl]amino]-4-(4-hydroxyphenyl)butanoyl]amino]pentanediamide, N~1~-[(2S,5S,8S,11R,12S,15S,18R,21R)-8-[(2R)-Butan-2-yl]-21-hydroxy-2-[(1R)-1-hydroxyethyl]-5-[(4-hydroxyphenyl)methyl]-4,11-dimethyl-15-(2-methylpropyl)-3,6,9,13,16,22-hexaoxo-10-oxa-1,4,7,14,17-pentaazabicyclo[16.3.1]docosan-12-yl]-N~2~-[(2S)-2-{[(2R)-2,3-dihydroxypropanoyl]amino}-4-(4-hydroxyphenyl)butanoyl]glutamamide
| Molecular Formula | C53H77N9O17 |
|---|---|
| Molecular Weight | 1111.54 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 406.0 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 20 |
| Exact Mass | 1111.5437 |
| Heavy Atoms | 79 |
| Complexity | 2120.0 |
Chemical Identifiers
| CAS Number | 172548-91-3 |
|---|---|
| SMILES | CC[C@@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N1)CC3=CC=C(C=C3)O)C)[C@@H](C)O)O)CC(C)C)NC(=O)C(CCC(=O)N)NC(=O)[C@H](CCC4=CC=C(C=C4)O)NC(=O)[C@@H](CO)O)C |
| InChIKey | QLOMTVNWPCVFDT-KVYWPBGVSA-N |
Product Overview
oscillapeptin G (CAS 172548-91-3), with molecular formula C53H77N9O17 and molecular weight 1111.54 g/mol. IUPAC: N-[(2S,5S,8S,11R,12S,15S,18R,21R)-8-[(2R)-butan-2-yl]-21-hydroxy-2-[(1R)-1-hydroxyethyl]-5-[(4-hydroxyphenyl)methyl]-4,11-dimethyl-15-(2-methylpropyl)-3,6,9,13,16,22-hexaoxo-10-oxa-1,4,7,14,17-pentazabicyclo[16.3.1]docosan-12-yl]-2-[[(2S)-2-[[(2R)-2,3-dihydroxypropanoyl]amino]-4-(4-hydroxyphenyl)butanoyl]amino]pentanediamide.
Chemical Property Profile of oscillapeptin G
Property Insights of oscillapeptin G
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for oscillapeptin G. The TPSA of 406.0 Ų indicates high polarity, suggesting oscillapeptin G may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, oscillapeptin G has 13 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 oscillapeptin G?
The CAS number of oscillapeptin G is 172548-91-3.
What is the molecular formula of oscillapeptin G?
The molecular formula of oscillapeptin G is C53H77N9O17.
What is the molecular weight of oscillapeptin G?
The molecular weight of oscillapeptin G is 1111.54 g/mol.
Where can I buy oscillapeptin G?
You can request a quote for oscillapeptin G directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for oscillapeptin G?
Yes, KEHONG BIO provides custom synthesis services for oscillapeptin G and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.