Spartanamicin B
TL;DR: Spartanamicin B (CAS 66808-28-4) is a chemical compound with molecular formula C42H53NO16 and molecular weight 827.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1R,2R,4S)-4-[(2R,4S,5S,6S)-4-(dimethylamino)-5-[(2S,4S,5S,6S)-4-hydroxy-6-methyl-5-[(2R,6R)-6-methyl-5-oxooxan-2-yl]oxyoxan-2-yl]oxy-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7,10-tetrahydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate
Also Known As: Spartanamicin B, Antibiotic MA 144G2, Antibiotic MA-144G2, MA144 G2, MA-144G2
| Molecular Formula | C42H53NO16 |
|---|---|
| Molecular Weight | 827.34 g/mol |
| LogP | 2.8633 |
| Topological Polar Surface Area | 237.28 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 9 |
| Exact Mass | 827.3364 |
| Heavy Atoms | 59 |
| Complexity | 1990.3582 |
Chemical Identifiers
| CAS Number | 66808-28-4 |
|---|---|
| SMILES | CC[C@]1(C[C@@H](C2=C(C3=C(C=C2[C@H]1C(=O)OC)C(=O)C4=C(C=CC(=C4C3=O)O)O)O)O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O[C@H]6C[C@@H]([C@@H]([C@@H](O6)C)O[C@H]7CCC(=O)[C@H](O7)C)O)N(C)C)O |
Product Overview
Spartanamicin B (CAS 66808-28-4), with molecular formula C42H53NO16 and molecular weight 827.34 g/mol. IUPAC: methyl (1R,2R,4S)-4-[(2R,4S,5S,6S)-4-(dimethylamino)-5-[(2S,4S,5S,6S)-4-hydroxy-6-methyl-5-[(2R,6R)-6-methyl-5-oxooxan-2-yl]oxyoxan-2-yl]oxy-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7,10-tetrahydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate.
Chemical Property Profile of Spartanamicin B
Property Insights of Spartanamicin B
The XLogP value of 2.8633 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Spartanamicin B. The TPSA of 237.28 Ų indicates high polarity, suggesting Spartanamicin B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Spartanamicin B has 5 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 Spartanamicin B?
The CAS number of Spartanamicin B is 66808-28-4.
What is the molecular formula of Spartanamicin B?
The molecular formula of Spartanamicin B is C42H53NO16.
What is the molecular weight of Spartanamicin B?
The molecular weight of Spartanamicin B is 827.34 g/mol.
Where can I buy Spartanamicin B?
You can request a quote for Spartanamicin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spartanamicin B?
Yes, KEHONG BIO provides custom synthesis services for Spartanamicin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.