硫酸培普利欧霉素
TL;DR: 硫酸培普利欧霉素 (CAS 70384-29-1) is a chemical compound with molecular formula C61H90N18O25S3 and molecular weight 1570.55 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫酸培普利欧霉素
[2-[2-[2-[[6-amino-2-[3-amino-1-[(2,3-diamino-3-oxopropyl)amino]-3-oxopropyl]-5-methylpyrimidine-4-carbonyl]amino]-3-[[3-hydroxy-5-[[3-hydroxy-1-oxo-1-[2-[4-[4-[3-(1-phenylethylamino)propylcarbamoyl]-1,3-thiazol-2-yl]-1,3-thiazol-2-yl]ethylamino]butan-2-yl]amino]-4-methyl-5-oxopentan-2-yl]amino]-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] carbamate;sulfuric acid
Also Known As: peplomycin sulfate, Pepleo, Pepleomycin sulfate, Pepleomycin, Peplomycin sulfate salt
| Molecular Formula | C61H90N18O25S3 |
|---|---|
| Molecular Weight | 1570.55 g/mol |
| LogP | -6.88 |
| Topological Polar Surface Area | 779.0 Ų |
| Hydrogen Bond Donors | 23 |
| Hydrogen Bond Acceptors | 36 |
| Rotatable Bonds | 38 |
| Exact Mass | 1570.5487 |
| Heavy Atoms | 107 |
| Complexity | 2820.0 |
Chemical Identifiers
| CAS Number | 70384-29-1 |
|---|---|
| SMILES | CC1=C(N=C(N=C1N)C(CC(=O)N)NCC(C(=O)N)N)C(=O)NC(C(C2=CN=CN2)OC3C(C(C(C(O3)CO)O)O)OC4C(C(C(C(O4)CO)O)OC(=O)N)O)C(=O)NC(C)C(C(C)C(=O)NC(C(C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCCNC(C)C7=CC=CC=C7)O.OS(=O)(=O)O |
| InChIKey | ZHHIHQFAUZZMTG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
硫酸培普利欧霉素 (CAS 70384-29-1), with molecular formula C61H90N18O25S3 and molecular weight 1570.55 g/mol. IUPAC: [2-[2-[2-[[6-amino-2-[3-amino-1-[(2,3-diamino-3-oxopropyl)amino]-3-oxopropyl]-5-methylpyrimidine-4-carbonyl]amino]-3-[[3-hydroxy-5-[[3-hydroxy-1-oxo-1-[2-[4-[4-[3-(1-phenylethylamino)propylcarbamoyl]-1,3-thiazol-2-yl]-1,3-thiazol-2-yl]ethylamino]butan-2-yl]amino]-4-methyl-5-oxopentan-2-yl]amino]-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] carbamate;sulfuric acid.
Chemical Property Profile of 硫酸培普利欧霉素
Property Insights of 硫酸培普利欧霉素
The XLogP value of -6.88 indicates that 硫酸培普利欧霉素 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 779.0 Ų indicates high polarity, suggesting 硫酸培普利欧霉素 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 硫酸培普利欧霉素 has 23 hydrogen bond donor(s) and 36 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 硫酸培普利欧霉素?
The CAS number of 硫酸培普利欧霉素 is 70384-29-1.
What is the molecular formula of 硫酸培普利欧霉素?
The molecular formula of 硫酸培普利欧霉素 is C61H90N18O25S3.
What is the molecular weight of 硫酸培普利欧霉素?
The molecular weight of 硫酸培普利欧霉素 is 1570.55 g/mol.
Where can I buy 硫酸培普利欧霉素?
You can request a quote for 硫酸培普利欧霉素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫酸培普利欧霉素?
Yes, KEHONG BIO provides custom synthesis services for 硫酸培普利欧霉素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.