18-Hydroxyascomycin
TL;DR: 18-Hydroxyascomycin (CAS 143839-74-1) is a chemical compound with molecular formula C43H69NO13 and molecular weight 807.47687 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,9S,12S,13R,14S,17R,18E,20S,21R,23S,24R,25S,27R)-17-ethyl-1,14,20-trihydroxy-12-[(E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone
Also Known As: 18-HYDROXYASCOMYCIN, L-685,818, L 685818, (1R,9S,12S,13R,14S,17R,18E,20S,21R,23S,24R,25S,27R)-17-ethyl-1,14,20-trihydroxy-12-[(E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone, (3S,4R,5S,8R,9E,11S,12R,14S,15R,16S,18R,19R,26aS)-8-ethyl-5,11,19-trihydroxy-3-{(E)-2-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]-1-methylethenyl}-14,16-dimethoxy-4,10,12,18-tetramethyl-5,6,8,11,12,13,14,15,16,17,18,19,24,25,26,26a-hexadecahydro-3H-15,19-epoxypyrido[2,1-c][1,4]oxazacyclotricosine-1,7,20,21(4H,23H)-tetrone
Technical Specifications
| Molecular Formula | C43H69NO13 |
| Molecular Weight | 807.47687 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 199.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 807.47687 Da |
| Heavy Atoms | 57 |
| Complexity | 1470.0 |
| SMILES | CC[C@@H]1/C=C(/[C@H]([C@@H](C[C@@H]([C@@H]2[C@H](C[C@H]([C@@](O2)(C(=O)C(=O)N3CCCC[C@H]3C(=O)O[C@@H]([C@@H]([C@H](CC1=O)O)C)/C(=C/[C@@H]4CC[C@H]([C@@H](C4)OC)O)/C)O)C)OC)OC)C)O)\C |
| InChIKey | NOQNPBXNHMZMTC-UGTSZWOVSA-N |
Chemical Property Profile of 18-Hydroxyascomycin
Property Insights of 18-Hydroxyascomycin
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 18-Hydroxyascomycin. The TPSA of 199.0 Ų indicates high polarity, suggesting 18-Hydroxyascomycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 18-Hydroxyascomycin has 4 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 18-Hydroxyascomycin?
The CAS number of 18-Hydroxyascomycin is 143839-74-1.
What is the molecular formula of 18-Hydroxyascomycin?
The molecular formula of 18-Hydroxyascomycin is C43H69NO13.
What is the molecular weight of 18-Hydroxyascomycin?
The molecular weight of 18-Hydroxyascomycin is 807.47687 g/mol.
Where can I buy 18-Hydroxyascomycin?
You can request a quote for 18-Hydroxyascomycin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 18-Hydroxyascomycin?
Yes, CoreyChem provides custom synthesis services for 18-Hydroxyascomycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.