PRADIMICIN ANALOG
TL;DR: PRADIMICIN ANALOG (CAS 148677-11-6) is a chemical compound with molecular formula C39H41NO19 and molecular weight 827.2273 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(5S,6S)-1,6,9,14-tetrahydroxy-5-[(2S,3R,4S,5S,6R)-3-hydroxy-6-methyl-5-(methylamino)-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-11-methoxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carbonyl]oxyacetic acid
Also Known As: PRADIMICIN ANALOG, Benzo(a)naphthacene-2-carboxylic acid, 5-((4,6-dideoxy-4-(methylamino)-3-O-beta-D-xylopyranosyl-beta-D-galactopyranosyl)oxy)-5,6,8,13-tetrahydro-1,6,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxo-, carboxymethyl ester, (5S-trans)-, (5S)-5alpha-[(4-Methylamino-3-O-beta-D-xylopyranosyl-4,6-dideoxy-beta-D-galactopyranosyl)oxy]-5,6,8,13-tetrahydro-1,6beta,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxobenzo[a]naphthacene-2-carboxylic acid 2-hydroxy-2-oxoethyl ester, {[(5S,6S)-5-{[4,6-Dideoxy-4-(methylamino)-3-O-beta-D-xylopyranosyl-beta-D-galactopyranosyl]oxy}-1,6,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxo-5,6,8,13-tetrahydrobenzo[a]tetracene-2-carbonyl]oxy}acetic acid, 2-[(10S,11S)-2,5,11,17-tetrahydroxy-10-{[(2S,3R,4S,5S,6R)-3-hydroxy-6-methyl-5-(methylamino)-4-{[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-19-methoxy-7-methyl-15,22-dioxopentacyclo[12.8.0.03,12.04,9.016,21]docosa-1(14),2,4,6,8,12,16,18,20-nonaene-6-carbonyloxy]acetic acid
Technical Specifications
| Molecular Formula | C39H41NO19 |
| Molecular Weight | 827.2273 g/mol |
| XLogP | -1.7 |
| Topological Polar Surface Area (TPSA) | 318.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 10 |
| Exact Mass | 827.2273 Da |
| Heavy Atoms | 59 |
| Complexity | 1570.0 |
| 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)OCC(=O)O)C)O)C(=O)C6=C(C4=O)C(=CC(=C6)OC)O)O)O)O[C@H]7[C@@H]([C@H]([C@@H](CO7)O)O)O)NC |
| InChIKey | QEMLBHMYFQWYON-PCAYTWTGSA-N |
Chemical Property Profile of PRADIMICIN ANALOG
Property Insights of PRADIMICIN ANALOG
The XLogP value of -1.7 indicates that PRADIMICIN ANALOG is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 318.0 Ų indicates high polarity, suggesting PRADIMICIN ANALOG may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, PRADIMICIN ANALOG has 10 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 ANALOG?
The CAS number of PRADIMICIN ANALOG is 148677-11-6.
What is the molecular formula of PRADIMICIN ANALOG?
The molecular formula of PRADIMICIN ANALOG is C39H41NO19.
What is the molecular weight of PRADIMICIN ANALOG?
The molecular weight of PRADIMICIN ANALOG is 827.2273 g/mol.
Where can I buy PRADIMICIN ANALOG?
You can request a quote for PRADIMICIN ANALOG directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for PRADIMICIN ANALOG?
Yes, CoreyChem provides custom synthesis services for PRADIMICIN ANALOG and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.