10-Carboxypradimicin A
TL;DR: 10-Carboxypradimicin A (CAS 153619-29-5) is a chemical compound with molecular formula C41H44N2O20 and molecular weight 884.2487 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5S,6S)-2-[[(1R)-1-carboxyethyl]carbamoyl]-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-10-carboxylic acid
Also Known As: 10-Carboxypradimicin A, Benzo(a)naphthacene-10-carboxylic acid, 2-(((1-carboxyethyl)amino)carbonyl)-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-, (5S-(2(S*),5a,6b))-, (10S,11S)-6-{[(1R)-1-carboxyethyl]carbamoyl}-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-18-carboxylic acid, (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-2-[[(2R)-1-hydroxy-1-oxopropan-2-yl]carbamoyl]-11-methoxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-10-carboxylic acid, (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-trihydroxytetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-2-[[(1R)-2-hydroxy-1-methyl-2-oxo-ethyl]carbamoyl]-11-methoxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-10-carboxylic acid
Technical Specifications
| Molecular Formula | C41H44N2O20 |
| Molecular Weight | 884.2487 g/mol |
| XLogP | -2.4 |
| Topological Polar Surface Area (TPSA) | 358.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 10 |
| Exact Mass | 884.2487 Da |
| Heavy Atoms | 63 |
| Complexity | 1740.0 |
| 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)N[C@H](C)C(=O)O)C)O)C(=O)C6=CC(=C(C(=C6C4=O)O)C(=O)O)OC)O)O)O[C@H]7[C@@H]([C@H]([C@@H](CO7)O)O)O)NC |
| InChIKey | IFMCWMDIILMOIM-FGURBXLXSA-N |
Chemical Property Profile of 10-Carboxypradimicin A
Property Insights of 10-Carboxypradimicin A
The XLogP value of -2.4 indicates that 10-Carboxypradimicin A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 358.0 Ų indicates high polarity, suggesting 10-Carboxypradimicin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 10-Carboxypradimicin A has 12 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 10-Carboxypradimicin A?
The CAS number of 10-Carboxypradimicin A is 153619-29-5.
What is the molecular formula of 10-Carboxypradimicin A?
The molecular formula of 10-Carboxypradimicin A is C41H44N2O20.
What is the molecular weight of 10-Carboxypradimicin A?
The molecular weight of 10-Carboxypradimicin A is 884.2487 g/mol.
Where can I buy 10-Carboxypradimicin A?
You can request a quote for 10-Carboxypradimicin A directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 10-Carboxypradimicin A?
Yes, CoreyChem provides custom synthesis services for 10-Carboxypradimicin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.