PRADIMICIN DER
TL;DR: PRADIMICIN DER (CAS 153619-36-4) is a chemical compound with molecular formula C39H40FNO19 and molecular weight 845.21783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[(5S,6S)-5-[(2S,3R,4S,5S,6R)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-11-(2-fluoroethoxy)-1,6,9,14-tetrahydroxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carbonyl]amino]acetic acid
Also Known As: PRADIMICIN DER, Glycine, N-((5-((6-deoxy-3-O-beta-D-xylopyranosyl-beta-D-galactopyranosyl)oxy)-11-(2-fluoroethoxy)-5,6,8,13-tetrahydro-1,6,9,14-tetrahydroxy-3-methyl-8,13-dioxobenzo(a)naphthacen-2-yl)carbonyl)-, (5S-trans)-, [(5S,6S)-5-{[(2S,3R,4S,5S,6R)-3,5-Dihydroxy-6-methyl-4-{[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-11-(2-fluoroethoxy)-1,6,9,14-tetrahydroxy-3-methyl-8,13-dioxo-5,6,8,13-tetrahydrobenzo[a]tetracene-2-carboxamido]acetic acid, 2-[[(5S,6S)-5-[(2S,3R,4S,5S,6R)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-11-(2-fluoroethoxy)-1,6,9,14-tetrahydroxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carbonyl]amino]acetic acid, 2-[[(5S,6S)-5-[(2S,3R,4S,5S,6R)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4S,5R)-3,4,5-trihydroxytetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-11-(2-fluoroethoxy)-1,6,9,14-tetrahydroxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carbonyl]amino]acetic acid
Technical Specifications
| Molecular Formula | C39H40FNO19 |
| Molecular Weight | 845.21783 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 329.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 10 |
| Exact Mass | 845.21783 Da |
| Heavy Atoms | 60 |
| Complexity | 1590.0 |
| SMILES | C[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](C3=CC4=C(C(=C3C5=C2C=C(C(=C5O)C(=O)NCC(=O)O)C)O)C(=O)C6=C(C4=O)C(=CC(=C6)OCCF)O)O)O)O[C@H]7[C@@H]([C@H]([C@@H](CO7)O)O)O)O |
| InChIKey | PFIBNGKCPGAJCL-PCAYTWTGSA-N |
Chemical Property Profile of PRADIMICIN DER
Property Insights of PRADIMICIN DER
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for PRADIMICIN DER. The TPSA of 329.0 Ų indicates high polarity, suggesting PRADIMICIN DER may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, PRADIMICIN DER has 11 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of PRADIMICIN DER?
The CAS number of PRADIMICIN DER is 153619-36-4.
What is the molecular formula of PRADIMICIN DER?
The molecular formula of PRADIMICIN DER is C39H40FNO19.
What is the molecular weight of PRADIMICIN DER?
The molecular weight of PRADIMICIN DER is 845.21783 g/mol.
Where can I buy PRADIMICIN DER?
You can request a quote for PRADIMICIN DER directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for PRADIMICIN DER?
Yes, CoreyChem provides custom synthesis services for PRADIMICIN DER and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.