Α-新内啡肽
TL;DR: Α-新内啡肽 (CAS 77739-20-9) is a chemical compound with molecular formula C60H89N15O13 and molecular weight 1227.68 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Α-新内啡肽
(2S)-6-amino-2-[[(2S)-1-[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]amino]hexanoic acid
Also Known As: alpha-Neoendorphin, alpha-Neo-endorphin, a-Neoendorphin, A-Neoendorphin, alpha-neodynorphin
| Molecular Formula | C60H89N15O13 |
|---|---|
| Molecular Weight | 1227.68 g/mol |
| LogP | -1.9725 |
| Topological Polar Surface Area | 473.33 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 38 |
| Exact Mass | 1227.6764 |
| Heavy Atoms | 88 |
| Complexity | 2804.977 |
Chemical Identifiers
| CAS Number | 77739-20-9 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)CNC(=O)CNC(=O)[C@H](CC4=CC=C(C=C4)O)N |
Product Overview
Α-新内啡肽 (CAS 77739-20-9), with molecular formula C60H89N15O13 and molecular weight 1227.68 g/mol. IUPAC: (2S)-6-amino-2-[[(2S)-1-[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]amino]hexanoic acid.
Chemical Property Profile of Α-新内啡肽
Property Insights of Α-新内啡肽
The XLogP value of -1.9725 indicates that Α-新内啡肽 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 473.33 Ų indicates high polarity, suggesting Α-新内啡肽 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Α-新内啡肽 has 16 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Α-新内啡肽?
The CAS number of Α-新内啡肽 is 77739-20-9.
What is the molecular formula of Α-新内啡肽?
The molecular formula of Α-新内啡肽 is C60H89N15O13.
What is the molecular weight of Α-新内啡肽?
The molecular weight of Α-新内啡肽 is 1227.68 g/mol.
Where can I buy Α-新内啡肽?
You can request a quote for Α-新内啡肽 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Α-新内啡肽?
Yes, KEHONG BIO provides custom synthesis services for Α-新内啡肽 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.