RefChem:1049478
TL;DR: RefChem:1049478 (CAS 104987-09-9) is a chemical compound with molecular formula C42H67NO12 and molecular weight 777.4663 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,9S,12S,13R,14S,17R,18E,21S,23S,24R,25S,27R)-1,14-dihydroxy-12-[(E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl]-23,25-dimethoxy-13,17,19,21,27-pentamethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone
Also Known As: FR 900523, J2.024.005I, 15,19-Epoxy-3H-pyrido(2,1-c)(1,4)oxaazacyclotricosine-1,7,20,21(4H,23H)-tetrone, 5,6,8,11,12,13,14,15,16,17,18,19,24,25,26,26a-hexadecahydro-5,19-dihydroxy-3-(2-(4-hydroxy-3-methoxycyclohexyl)-1-methylethenyl)-14,16-dimethoxy-4,8,10,12,18-pentamethyl-, (3S-(3R*(E(1S*,3S*,4S*)),4S*,5R*,8S*,9E,12R*,14R*,15S*,16R*,18S*,19S*,26aR*))-, (1R,9S,12S,13R,14S,17R,18E,21S,23S,24R,25S,27R)-1,14-Dihydroxy-12-[(E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl]-23,25-dimethoxy-13,17,19,21,27-pentamethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone, (1R,9S,12S,13R,14S,17R,18E,21S,23S,24R,25S,27R)-1,14-dihydroxy-12-((E)-1-((1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl)prop-1-en-2-yl)-23,25-dimethoxy-13,17,19,21,27-pentamethyl-11,28-dioxa-4-azatricyclo(22.3.1.04,9)octacos-18-ene-2,3,10,16-tetrone
Technical Specifications
| Molecular Formula | C42H67NO12 |
| Molecular Weight | 777.4663 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 178.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 777.4663 Da |
| Heavy Atoms | 55 |
| Complexity | 1410.0 |
| SMILES | C[C@@H]1C[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](CC(=O)[C@@H](/C=C(/C1)\C)C)O)C)/C(=C/[C@@H]4CC[C@H]([C@@H](C4)OC)O)/C)O)C)OC)OC |
| InChIKey | UBQBKOBGHRTZRG-UPAXIQFWSA-N |
Product Description
Applications: RefChem:1049478 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies RefChem:1049478 (CAS 104987-09-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A fine chemical supplied by CoreyChem, RefChem:1049478 (CAS 104987-09-9) has the molecular formula C42H67NO12 and a molecular weight of 777.47 g/mol. It is also known as FR 900523 and J2.024.005I.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of RefChem:1049478
Property Insights of RefChem:1049478
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1049478. The TPSA of 178.0 Ų indicates high polarity, suggesting RefChem:1049478 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1049478 has 3 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:1049478?
The CAS number of RefChem:1049478 is 104987-09-9.
What is the molecular formula of RefChem:1049478?
The molecular formula of RefChem:1049478 is C42H67NO12.
What is the molecular weight of RefChem:1049478?
The molecular weight of RefChem:1049478 is 777.4663 g/mol.
What are the applications of RefChem:1049478?
RefChem:1049478 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies RefChem:1049478 (CAS 104987-09-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and...
Where can I buy RefChem:1049478?
You can request a quote for RefChem:1049478 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1049478?
Yes, CoreyChem provides custom synthesis services for RefChem:1049478 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.