Edeine B
TL;DR: Edeine B (CAS 27656-73-1) is a chemical compound with molecular formula C34H60N12O10 and molecular weight 796.46 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-2-[[3-amino-2-[[3-[[3-amino-3-(4-hydroxyphenyl)propanoyl]amino]-2-hydroxypropanoyl]amino]propanoyl]amino]-9-[[2-[3-[4-(diaminomethylideneamino)butylamino]propylamino]-2-oxoethyl]amino]-7-hydroxy-9-oxononanoic acid
Also Known As: Edeine B, Edeine B1, 6-amino-2-[[3-amino-2-[[3-[[3-amino-3-(4-hydroxyphenyl)propanoyl]amino]-2-hydroxypropanoyl]amino]propanoyl]amino]-9-[[2-[3-[4-(diaminomethylideneamino)butylamino]propylamino]-2-oxoethyl]amino]-7-hydroxy-9-oxononanoic acid, 1,18-Diamino-22-({3-amino-2-[(3-{[3-amino-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino}-1,2-dihydroxypropylidene)amino]-1-hydroxypropylidene}amino)-12,15,17-trihydroxy-1-imino-2,7,11,14-tetraazatricosa-11,14-dien-23-oic acid, Glycinamide, N8-[(3S)-3-(4-hydroxyphenyl)-beta-alanyl-(3S)-2-hydroxy-beta-alanyl-3-amino-L-alanyl]-(3R,4S,8R)-4,8-diamino-8-carboxy-3-hydroxyoctanoyl-N-[3-[[4-(aminominomethyl)amino]butyl]amino]propyl]-
| Molecular Formula | C34H60N12O10 |
|---|---|
| Molecular Weight | 796.46 g/mol |
| LogP | -5.2136 |
| Topological Polar Surface Area | 397.98 Ų |
| Hydrogen Bond Donors | 15 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 29 |
| Exact Mass | 796.45557 |
| Heavy Atoms | 56 |
| Complexity | 1414.5433 |
Chemical Identifiers
| CAS Number | 27656-73-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C(CC(=O)NCC(C(=O)NC(CN)C(=O)NC(CCCC(C(CC(=O)NCC(=O)NCCCNCCCCN=C(N)N)O)N)C(=O)O)O)N)O |
Product Overview
Edeine B (CAS 27656-73-1), with molecular formula C34H60N12O10 and molecular weight 796.46 g/mol. IUPAC: 6-amino-2-[[3-amino-2-[[3-[[3-amino-3-(4-hydroxyphenyl)propanoyl]amino]-2-hydroxypropanoyl]amino]propanoyl]amino]-9-[[2-[3-[4-(diaminomethylideneamino)butylamino]propylamino]-2-oxoethyl]amino]-7-hydroxy-9-oxononanoic acid.
Chemical Property Profile of Edeine B
Property Insights of Edeine B
The XLogP value of -5.2136 indicates that Edeine B is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 397.98 Ų indicates high polarity, suggesting Edeine B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Edeine B has 15 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 Edeine B?
The CAS number of Edeine B is 27656-73-1.
What is the molecular formula of Edeine B?
The molecular formula of Edeine B is C34H60N12O10.
What is the molecular weight of Edeine B?
The molecular weight of Edeine B is 796.46 g/mol.
Where can I buy Edeine B?
You can request a quote for Edeine B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Edeine B?
Yes, KEHONG BIO provides custom synthesis services for Edeine B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.