Octadecanoic acid--4-O-hexopyranosylhexose (1/1)
TL;DR: Octadecanoic acid--4-O-hexopyranosylhexose (1/1) (CAS 51801-29-7) is a chemical compound with molecular formula C30H58O13 and molecular weight 626.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octadecanoic acid;2,3,5,6-tetrahydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanal
Also Known As: Octadecanoic acid--4-O-hexopyranosylhexose (1/1), Octadecanoic acid; 2,3,5,6-tetrahydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-hexanal, 2,3,5,6-tetrahydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-hexanal, octadecanoic acid,2,3,5,6-tetrahydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanal, octadecanoic acid; 2,3,5,6-tetrahydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanal
| Molecular Formula | C30H58O13 |
|---|---|
| Molecular Weight | 626.39 g/mol |
| LogP | 0.7779 |
| Topological Polar Surface Area | 235.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 24 |
| Exact Mass | 626.38776 |
| Heavy Atoms | 43 |
| Complexity | 569.0 |
Chemical Identifiers
| CAS Number | 51801-29-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)O.C(C1C(C(C(C(O1)OC(C(CO)O)C(C(C=O)O)O)O)O)O)O |
| InChIKey | DQFUQHWIFQEYOU-UHFFFAOYSA-N |
Product Overview
Octadecanoic acid--4-O-hexopyranosylhexose (1/1) (CAS 51801-29-7), with molecular formula C30H58O13 and molecular weight 626.39 g/mol. IUPAC: octadecanoic acid;2,3,5,6-tetrahydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanal.
Chemical Property Profile of Octadecanoic acid--4-O-hexopyranosylhexose (1/1)
Property Insights of Octadecanoic acid--4-O-hexopyranosylhexose (1/1)
The XLogP value of 0.7779 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Octadecanoic acid--4-O-hexopyranosylhexose (1/1). The TPSA of 235.0 Ų indicates high polarity, suggesting Octadecanoic acid--4-O-hexopyranosylhexose (1/1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Octadecanoic acid--4-O-hexopyranosylhexose (1/1) has 9 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Octadecanoic acid--4-O-hexopyranosylhexose (1/1)?
The CAS number of Octadecanoic acid--4-O-hexopyranosylhexose (1/1) is 51801-29-7.
What is the molecular formula of Octadecanoic acid--4-O-hexopyranosylhexose (1/1)?
The molecular formula of Octadecanoic acid--4-O-hexopyranosylhexose (1/1) is C30H58O13.
What is the molecular weight of Octadecanoic acid--4-O-hexopyranosylhexose (1/1)?
The molecular weight of Octadecanoic acid--4-O-hexopyranosylhexose (1/1) is 626.39 g/mol.
Where can I buy Octadecanoic acid--4-O-hexopyranosylhexose (1/1)?
You can request a quote for Octadecanoic acid--4-O-hexopyranosylhexose (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octadecanoic acid--4-O-hexopyranosylhexose (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Octadecanoic acid--4-O-hexopyranosylhexose (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.