Org 31258
TL;DR: Org 31258 (CAS 1501-72-0) is a chemical compound with molecular formula C60H102N14O21 and molecular weight 1354.73 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-acetamido-2-[[(2S)-2-[[(2S)-1-[(2S,3R)-2-amino-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]amino]-4-carboxybutanoyl]amino]hexanoyl]amino]-3-hydroxypropanoyl]amino]-5-amino-5-oxopentanoyl]amino]-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylpentanoic acid
Also Known As: Org 31258, 7-Pro-9-acetyl-lys-beta-endorphin (6-17), beta-Endorphin (6-17), pro(7)-lys(Ac)(9)-, beta-Endorphin (6-17), pro(7)-acetyl-lys(9)-, (2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-Acetamido-2-[[(2S)-2-[[(2S)-1-[(2S,3R)-2-amino-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]amino]-4-carboxybutanoyl]amino]hexanoyl]amino]-3-hydroxypropanoyl]amino]-5-amino-5-oxopentanoyl]amino]-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylpentanoic acid
| Molecular Formula | C60H102N14O21 |
|---|---|
| Molecular Weight | 1354.73 g/mol |
| LogP | -6.1 |
| Topological Polar Surface Area | 556.0 Ų |
| Hydrogen Bond Donors | 18 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 41 |
| Exact Mass | 1354.7344 |
| Heavy Atoms | 95 |
| Complexity | 2700.0 |
Chemical Identifiers
| CAS Number | 1501-72-0 |
|---|---|
| SMILES | C[C@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCNC(=O)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)O)N)O |
| InChIKey | OUUBPYALVBZKGP-BUXAMNFFSA-N |
Product Overview
Org 31258 (CAS 1501-72-0), with molecular formula C60H102N14O21 and molecular weight 1354.73 g/mol. IUPAC: (2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-acetamido-2-[[(2S)-2-[[(2S)-1-[(2S,3R)-2-amino-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]amino]-4-carboxybutanoyl]amino]hexanoyl]amino]-3-hydroxypropanoyl]amino]-5-amino-5-oxopentanoyl]amino]-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylpentanoic acid.
Chemical Property Profile of Org 31258
Property Insights of Org 31258
The XLogP value of -6.1 indicates that Org 31258 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 556.0 Ų indicates high polarity, suggesting Org 31258 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Org 31258 has 18 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Org 31258?
The CAS number of Org 31258 is 1501-72-0.
What is the molecular formula of Org 31258?
The molecular formula of Org 31258 is C60H102N14O21.
What is the molecular weight of Org 31258?
The molecular weight of Org 31258 is 1354.73 g/mol.
Where can I buy Org 31258?
You can request a quote for Org 31258 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Org 31258?
Yes, KEHONG BIO provides custom synthesis services for Org 31258 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.