alpha-Casein (90-96)
TL;DR: alpha-Casein (90-96) (CAS 83471-49-2) is a chemical compound with molecular formula C43H64N10O12 and molecular weight 912.47 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylpentanoyl]amino]acetyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylpentanoyl]amino]pentanedioic acid
Also Known As: alpha-Casein exorphine, alpha-Casein (90-96), alpha-Casein(90-96), A-Casein (90-96), a-Casein (90-96)
| Molecular Formula | C43H64N10O12 |
|---|---|
| Molecular Weight | 912.47 g/mol |
| LogP | -1.1543 |
| Topological Polar Surface Area | 380.08 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 28 |
| Exact Mass | 912.4705 |
| Heavy Atoms | 65 |
| Complexity | 1956.7756 |
Chemical Identifiers
| CAS Number | 83471-49-2 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)NCC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CCCN=C(N)N)N |
Product Overview
alpha-Casein (90-96) (CAS 83471-49-2), with molecular formula C43H64N10O12 and molecular weight 912.47 g/mol. IUPAC: (2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylpentanoyl]amino]acetyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylpentanoyl]amino]pentanedioic acid.
Chemical Property Profile of alpha-Casein (90-96)
Property Insights of alpha-Casein (90-96)
The XLogP value of -1.1543 indicates that alpha-Casein (90-96) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 380.08 Ų indicates high polarity, suggesting alpha-Casein (90-96) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, alpha-Casein (90-96) has 13 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of alpha-Casein (90-96)?
The CAS number of alpha-Casein (90-96) is 83471-49-2.
What is the molecular formula of alpha-Casein (90-96)?
The molecular formula of alpha-Casein (90-96) is C43H64N10O12.
What is the molecular weight of alpha-Casein (90-96)?
The molecular weight of alpha-Casein (90-96) is 912.47 g/mol.
Where can I buy alpha-Casein (90-96)?
You can request a quote for alpha-Casein (90-96) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Casein (90-96)?
Yes, KEHONG BIO provides custom synthesis services for alpha-Casein (90-96) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.