7-Ornithine-tyrocidine A
TL;DR: 7-Ornithine-tyrocidine A (CAS 79774-99-5) is a chemical compound with molecular formula C62H90Cl2N14O13 and molecular weight 1308.62 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-[(2S)-1-[[(2S)-1-[[(Z,2S)-5-amino-1-[[(2S)-1-[[(2R)-1-[(2S)-2-[[(2S)-1-[[(2S)-5-amino-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxopent-3-en-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]pentanediamide;dihydrochloride
Also Known As: Orn-TA, 7-Ornithine-tyrocidine A, (L-Orn(7))-TA, 7-L-Ornithine-tyrocidine A, Tyrocidine A, 10-L-ornithine-, dihydrochloride
| Molecular Formula | C62H90Cl2N14O13 |
|---|---|
| Molecular Weight | 1308.62 g/mol |
| LogP | -1.2439 |
| Topological Polar Surface Area | 454.65 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 37 |
| Exact Mass | 1308.6189 |
| Heavy Atoms | 91 |
| Complexity | 2928.3284 |
Chemical Identifiers
| CAS Number | 79774-99-5 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CCCN)C=O)NC(=O)[C@H](/C=C\CN)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(=O)N)N.Cl.Cl |
Product Overview
7-Ornithine-tyrocidine A (CAS 79774-99-5), with molecular formula C62H90Cl2N14O13 and molecular weight 1308.62 g/mol. IUPAC: (2S)-N-[(2S)-1-[[(2S)-1-[[(Z,2S)-5-amino-1-[[(2S)-1-[[(2R)-1-[(2S)-2-[[(2S)-1-[[(2S)-5-amino-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxopent-3-en-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]pentanediamide;dihydrochloride.
Chemical Property Profile of 7-Ornithine-tyrocidine A
Property Insights of 7-Ornithine-tyrocidine A
The XLogP value of -1.2439 indicates that 7-Ornithine-tyrocidine A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 454.65 Ų indicates high polarity, suggesting 7-Ornithine-tyrocidine A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 7-Ornithine-tyrocidine A has 14 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 7-Ornithine-tyrocidine A?
The CAS number of 7-Ornithine-tyrocidine A is 79774-99-5.
What is the molecular formula of 7-Ornithine-tyrocidine A?
The molecular formula of 7-Ornithine-tyrocidine A is C62H90Cl2N14O13.
What is the molecular weight of 7-Ornithine-tyrocidine A?
The molecular weight of 7-Ornithine-tyrocidine A is 1308.62 g/mol.
Where can I buy 7-Ornithine-tyrocidine A?
You can request a quote for 7-Ornithine-tyrocidine A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Ornithine-tyrocidine A?
Yes, KEHONG BIO provides custom synthesis services for 7-Ornithine-tyrocidine A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.