A-53930A
TL;DR: A-53930A (CAS 182410-79-3) is a chemical compound with molecular formula C37H70N14O11 and molecular weight 886.53 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,4S,5R,6R)-6-[[(3aS,7R,7aS)-7-hydroxy-4-oxo-1,3a,5,6,7,7a-hexahydroimidazo[4,5-c]pyridin-2-yl]amino]-5-[[3-amino-6-[[(3S)-3-amino-6-[[(3S)-3-amino-6-[[(3S)-3,6-diaminohexanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3,4-dihydroxyoxan-2-yl]methyl carbamate
Also Known As: A-53930A, A 53930A, [(2R,3R,4S,5R,6R)-6-[[(3aS,7R,7aS)-7-hydroxy-4-oxo-1,3a,5,6,7,7a-hexahydroimidazo[4,5-c]pyridin-2-yl]amino]-5-[[3-amino-6-[[(3S)-3-amino-6-[[(3S)-3-amino-6-[[(3S)-3,6-diaminohexanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3,4-dihydroxyoxan-2-yl]methyl carbamate, 4H-Imidazo(4,5-c)pyridin-4-one, 1,3a,5,6,7,7a-hexahydro-2-((2-((3-amino-6-(((3S)-3-amino-6-(((3S)-3-amino-6-(((3S)-3,6-diamino-1-oxohexyl)amino)-1-oxohexyl)amino)-1-oxohexyl)amino)-1-oxohexyl)amino)-6-O-(aminocarbonyl)-2-deoxy-beta-D-gulopyranosyl)amino)-7-hydroxy-, (3aS,7R,7aS)-, 4H-Imidazo(4,5-c)pyridin-4-one, 2-((2-((3-amino-6-((3-amino-6-((3-amino-6-((3,6-diamino-1-oxohexyl)amino)-1-oxohexyl)amino)-1-oxohexyl)amino)-1-oxohexyl)amino)-6-O-(aminocarbonyl)-2-deoxy-beta-D-gulopyranosyl)amino)-1,3a,5,6,7,7a-hexahydro-7-hydroxy-, (3aS-(2(R*(R*(R*))),3aalpha,7alpha,7abeta))-
| Molecular Formula | C37H70N14O11 |
|---|---|
| Molecular Weight | 886.53 g/mol |
| LogP | -6.9124 |
| Topological Polar Surface Area | 434.26 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 27 |
| Exact Mass | 886.53485 |
| Heavy Atoms | 62 |
| Complexity | 1497.7277 |
Chemical Identifiers
| CAS Number | 182410-79-3 |
|---|---|
| SMILES | C1[C@H]([C@@H]2[C@@H](C(=O)N1)N=C(N2)N[C@H]3[C@@H]([C@@H]([C@H]([C@H](O3)COC(=O)N)O)O)NC(=O)CC(CCCNC(=O)C[C@H](CCCNC(=O)C[C@H](CCCNC(=O)C[C@H](CCCN)N)N)N)N)O |
Product Overview
A-53930A (CAS 182410-79-3), with molecular formula C37H70N14O11 and molecular weight 886.53 g/mol. IUPAC: [(2R,3R,4S,5R,6R)-6-[[(3aS,7R,7aS)-7-hydroxy-4-oxo-1,3a,5,6,7,7a-hexahydroimidazo[4,5-c]pyridin-2-yl]amino]-5-[[3-amino-6-[[(3S)-3-amino-6-[[(3S)-3-amino-6-[[(3S)-3,6-diaminohexanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3,4-dihydroxyoxan-2-yl]methyl carbamate.
Chemical Property Profile of A-53930A
Property Insights of A-53930A
The XLogP value of -6.9124 indicates that A-53930A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 434.26 Ų indicates high polarity, suggesting A-53930A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, A-53930A has 16 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A-53930A?
The CAS number of A-53930A is 182410-79-3.
What is the molecular formula of A-53930A?
The molecular formula of A-53930A is C37H70N14O11.
What is the molecular weight of A-53930A?
The molecular weight of A-53930A is 886.53 g/mol.
Where can I buy A-53930A?
You can request a quote for A-53930A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A-53930A?
Yes, KEHONG BIO provides custom synthesis services for A-53930A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.