Compound NP-008104
TL;DR: Compound NP-008104 (CAS 11024-59-2) is a chemical compound with molecular formula C28H32O13 and molecular weight 576.18427 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one
4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one
Also Known As: Compound NP-008104, (-)-beta-Peltatin-5-o-beta-D-glucopyranoside, 4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one, 4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzouro[6,5-][1,3]benzodioxol-8-one
Technical Specifications
| Molecular Formula | C28H32O13 |
| Molecular Weight | 576.18427 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 172.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 7 |
| Exact Mass | 576.18427 Da |
| Heavy Atoms | 41 |
| Complexity | 907.0 |
| SMILES | COC1=CC(=CC(=C1OC)OC)C2C3C(CC4=C(C5=C(C=C24)OCO5)OC6C(C(C(C(O6)CO)O)O)O)COC3=O |
| InChIKey | PAIASCMUTMHGHU-UHFFFAOYSA-N |
Chemical Property Profile of Compound NP-008104
Property Insights of Compound NP-008104
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Compound NP-008104. The TPSA of 172.0 Ų indicates high polarity, suggesting Compound NP-008104 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Compound NP-008104 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 Compound NP-008104?
The CAS number of Compound NP-008104 is 11024-59-2.
What is the molecular formula of Compound NP-008104?
The molecular formula of Compound NP-008104 is C28H32O13.
What is the molecular weight of Compound NP-008104?
The molecular weight of Compound NP-008104 is 576.18427 g/mol.
Where can I buy Compound NP-008104?
You can request a quote for Compound NP-008104 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Compound NP-008104?
Yes, CoreyChem provides custom synthesis services for Compound NP-008104 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.