beta-Casomorphin 11
TL;DR: beta-Casomorphin 11 (CAS 101554-61-4) is a chemical compound with molecular formula C59H84N12O15 and molecular weight 1200.62 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-1-[(2S,3S)-2-[[(2S)-1-[2-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]acetyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxobutanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoic acid
Also Known As: beta-Casomorphin 11, Tyr-pro-phe-pro-gly-pro-ile-pro-asn-ser-leu, Tyrosyl-prolyl-phenylalanyl-prolyl-glycyl-prolyl-isoleucyl-prolyl-asparaginyl-seryl-leucine, L-Leucine, N-(N-(N2-(1-(N-(1-(N-(1-(N-(1-L-tyrosyl-L-prolyl)-L-phenylalanyl)-L-prolyl)glycyl)-L-prolyl)-L-isoleucyl)-L-prolyl)-L-asparginyl)-L-seryl)-, L-Tyrosyl-L-prolyl-L-phenylalanyl-L-prolylglycyl-L-prolyl-L-isoleucyl-L-prolyl-L-asparaginyl-L-seryl-L-leucine
| Molecular Formula | C59H84N12O15 |
|---|---|
| Molecular Weight | 1200.62 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 403.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 28 |
| Exact Mass | 1200.6179 |
| Heavy Atoms | 86 |
| Complexity | 2440.0 |
Chemical Identifiers
| CAS Number | 101554-61-4 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@H](CC4=CC=CC=C4)NC(=O)[C@@H]5CCCN5C(=O)[C@H](CC6=CC=C(C=C6)O)N |
| InChIKey | LGPVSBODEPGJNA-XPPITOOHSA-N |
Product Overview
beta-Casomorphin 11 (CAS 101554-61-4), with molecular formula C59H84N12O15 and molecular weight 1200.62 g/mol. IUPAC: (2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-1-[(2S,3S)-2-[[(2S)-1-[2-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]acetyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxobutanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoic acid.
Chemical Property Profile of beta-Casomorphin 11
Property Insights of beta-Casomorphin 11
The XLogP value of -1.8 indicates that beta-Casomorphin 11 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 403.0 Ų indicates high polarity, suggesting beta-Casomorphin 11 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, beta-Casomorphin 11 has 11 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 beta-Casomorphin 11?
The CAS number of beta-Casomorphin 11 is 101554-61-4.
What is the molecular formula of beta-Casomorphin 11?
The molecular formula of beta-Casomorphin 11 is C59H84N12O15.
What is the molecular weight of beta-Casomorphin 11?
The molecular weight of beta-Casomorphin 11 is 1200.62 g/mol.
Where can I buy beta-Casomorphin 11?
You can request a quote for beta-Casomorphin 11 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-Casomorphin 11?
Yes, KEHONG BIO provides custom synthesis services for beta-Casomorphin 11 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.