Pheganomycin DR
TL;DR: Pheganomycin DR (CAS 69280-91-7) is a chemical compound with molecular formula C36H59N13O13 and molecular weight 881.44 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-(diaminomethylideneamino)-2-[3,5-dihydroxy-4-(hydroxymethyl)phenyl]acetyl]amino]-4-oxobutanoyl]amino]-3,3-dimethylbutanoyl]amino]hexanoyl]amino]-3-carboxypropanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Also Known As: Pheganomycin DR, J3.199.406C, Arginine, N(sup 2)-(N-(N(sup 2)-(N-(N(sup 2)-(N-(aminoiminomethyl)-2-(3,5-dihydroxy-4-(hydroxymethyl)phenyl)glycyl)asparaginyl)-3-methylvalyl)lysyl)-alpha-aspartyl)-, (2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-carbamimidamido-2-[3,5-dihydroxy-4-(hydroxymethyl)phenyl]acetamido]-3-carbamoylpropanamido]-3,3-dimethylbutanamido]hexanamido]-3-carboxypropanamido]-5-carbamimidamidopentanoic acid, (2s)-2-[[(2s)-2-[[(2s)-6-amino-2-[[(2s)-2-[[(2s)-3-carbamoyl-2-[[(2s)-2-(diaminomethylideneamino)-2-[3,5-dihydroxy-4-(hydroxymethyl)phenyl]acetyl]amino]propanoyl]amino]-3,3-dimethyl-butanoyl]amino]hexanoyl]amino]-3-carboxy-propanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
| Molecular Formula | C36H59N13O13 |
|---|---|
| Molecular Weight | 881.44 g/mol |
| LogP | -5.008 |
| Topological Polar Surface Area | 478.7 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 26 |
| Exact Mass | 881.43555 |
| Heavy Atoms | 62 |
| Complexity | 1820.9614 |
Chemical Identifiers
| CAS Number | 69280-91-7 |
|---|---|
| SMILES | CC(C)(C)[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](C1=CC(=C(C(=C1)O)CO)O)N=C(N)N |
Product Overview
Pheganomycin DR (CAS 69280-91-7), with molecular formula C36H59N13O13 and molecular weight 881.44 g/mol. IUPAC: (2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-(diaminomethylideneamino)-2-[3,5-dihydroxy-4-(hydroxymethyl)phenyl]acetyl]amino]-4-oxobutanoyl]amino]-3,3-dimethylbutanoyl]amino]hexanoyl]amino]-3-carboxypropanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid.
Chemical Property Profile of Pheganomycin DR
Property Insights of Pheganomycin DR
The XLogP value of -5.008 indicates that Pheganomycin DR is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 478.7 Ų indicates high polarity, suggesting Pheganomycin DR may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pheganomycin DR has 16 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pheganomycin DR?
The CAS number of Pheganomycin DR is 69280-91-7.
What is the molecular formula of Pheganomycin DR?
The molecular formula of Pheganomycin DR is C36H59N13O13.
What is the molecular weight of Pheganomycin DR?
The molecular weight of Pheganomycin DR is 881.44 g/mol.
Where can I buy Pheganomycin DR?
You can request a quote for Pheganomycin DR directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pheganomycin DR?
Yes, KEHONG BIO provides custom synthesis services for Pheganomycin DR and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.