Formadicin A disodium dihydrate
TL;DR: Formadicin A disodium dihydrate (CAS 101757-61-3) is a chemical compound with molecular formula C30H31N4Na3O16 and molecular weight 772.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;(2S,3S,4S,5R,6R)-6-[4-[[3-[[(2R)-2-[4-(3-amino-3-carboxylatopropoxy)phenyl]-2-hydroxyacetyl]amino]-3-formamido-2-oxoazetidin-1-yl]-carboxylatomethyl]phenyl]-3,4,5,6-tetrahydroxyoxane-2-carboxylate
Also Known As: Formadicin A disodium dihydrate, Antibiotic TAN 585A disodium dihydrate, Antibiotic PA 42702B disodium dihydrate, beta-D-Glucopyranosiduronic acid, 4-((3-(((4-(3-amino-3-carboxypropoxy)phenyl)hydroxyacetyl)amino)-3-(formylamino)-2-oxo-1-azetidinyl)carboxymethyl)phenyl, sodium salt, hydrate (1:2:2),(3S-(1(S*),3R*(S*(S*))))-, trisodium (2S,3S,4S,5R,6R)-6-[4-[1-[3-[[(2R)-2-[4-(3-amino-4-oxido-4-oxobutoxy)phenyl]-2-hydroxyacetyl]amino]-3-formamido-2-oxoazetidin-1-yl]-2-oxido-2-oxoethyl]phenyl]-3,4,5,6-tetrahydroxyoxane-2-carboxylate
| Molecular Formula | C30H31N4Na3O16 |
|---|---|
| Molecular Weight | 772.14 g/mol |
| LogP | -17.1535 |
| Topological Polar Surface Area | 344.53 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 15 |
| Exact Mass | 772.1428 |
| Heavy Atoms | 53 |
| Complexity | 1640.1855 |
Chemical Identifiers
| CAS Number | 101757-61-3 |
|---|---|
| SMILES | C1C(C(=O)N1C(C2=CC=C(C=C2)[C@@]3([C@@H]([C@H]([C@@H]([C@H](O3)C(=O)[O-])O)O)O)O)C(=O)[O-])(NC=O)NC(=O)[C@@H](C4=CC=C(C=C4)OCCC(C(=O)[O-])N)O.[Na+].[Na+].[Na+] |
Product Overview
Formadicin A disodium dihydrate (CAS 101757-61-3), with molecular formula C30H31N4Na3O16 and molecular weight 772.14 g/mol. IUPAC: trisodium;(2S,3S,4S,5R,6R)-6-[4-[[3-[[(2R)-2-[4-(3-amino-3-carboxylatopropoxy)phenyl]-2-hydroxyacetyl]amino]-3-formamido-2-oxoazetidin-1-yl]-carboxylatomethyl]phenyl]-3,4,5,6-tetrahydroxyoxane-2-carboxylate.
Chemical Property Profile of Formadicin A disodium dihydrate
Property Insights of Formadicin A disodium dihydrate
The XLogP value of -17.1535 indicates that Formadicin A disodium dihydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 344.53 Ų indicates high polarity, suggesting Formadicin A disodium dihydrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Formadicin A disodium dihydrate has 8 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Formadicin A disodium dihydrate?
The CAS number of Formadicin A disodium dihydrate is 101757-61-3.
What is the molecular formula of Formadicin A disodium dihydrate?
The molecular formula of Formadicin A disodium dihydrate is C30H31N4Na3O16.
What is the molecular weight of Formadicin A disodium dihydrate?
The molecular weight of Formadicin A disodium dihydrate is 772.14 g/mol.
Where can I buy Formadicin A disodium dihydrate?
You can request a quote for Formadicin A disodium dihydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Formadicin A disodium dihydrate?
Yes, KEHONG BIO provides custom synthesis services for Formadicin A disodium dihydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.