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Catalpol [M+H]+ structure
Fine Chemical

Catalpol [M+H]+

TL;DR: Catalpol [M+H]+ (CAS 1276652-90-4) is a chemical compound with molecular formula C15H22O10 and molecular weight 362.1213 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[[5-hydroxy-2-(hydroxymethyl)-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-10-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Also Known As: Catalpol, Catalpinoside, Catalpol [M+H]+, Catalpinoside;De(p-hydroxybenzoyl)catalposide, (1aS,1bS,2S,5aR,6S,6aS)-1a,1b,2,5a,6,6a-Hexahydro-6-hydroxy-1a-(hydroxymethyl)oxireno[4,5]cyclopenta[1,2-c]pyran-2-yl-?-D-glucopyranoside Catalpinoside

CAS Number
1276652-90-4
Molecular Formula
C15H22O10
Molecular Weight
362.1213 g/mol
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Technical Specifications

Molecular FormulaC15H22O10
Molecular Weight362.1213 g/mol
XLogP-3.2
Topological Polar Surface Area (TPSA)162.0 Ų
Hydrogen Bond Donors6
Hydrogen Bond Acceptors10
Rotatable Bonds4
Exact Mass362.1213 Da
Heavy Atoms25
Complexity542.0
SMILESC1=COC(C2C1C(C3C2(O3)CO)O)OC4C(C(C(C(O4)CO)O)O)O
InChIKeyLHDWRKICQLTVDL-UHFFFAOYSA-N

Chemical Property Profile of Catalpol [M+H]+

XLogP
-3.2
TPSA (Topological Polar Surface Area)
162.0
Hydrogen Bond Donors
6
Hydrogen Bond Acceptors
10
Rotatable Bonds
4
Heavy Atoms
25
Complexity
542.0
Exact Mass
362.1213
Monoisotopic Mass
362.1213
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Catalpol [M+H]+

The XLogP value of -3.2 indicates that Catalpol [M+H]+ is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 162.0 Ų indicates high polarity, suggesting Catalpol [M+H]+ may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Catalpol [M+H]+ has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Catalpol [M+H]+?

The CAS number of Catalpol [M+H]+ is 1276652-90-4.

What is the molecular formula of Catalpol [M+H]+?

The molecular formula of Catalpol [M+H]+ is C15H22O10.

What is the molecular weight of Catalpol [M+H]+?

The molecular weight of Catalpol [M+H]+ is 362.1213 g/mol.

Where can I buy Catalpol [M+H]+?

You can request a quote for Catalpol [M+H]+ directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Catalpol [M+H]+?

Yes, CoreyChem provides custom synthesis services for Catalpol [M+H]+ and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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