Rubricauloside
TL;DR: Rubricauloside (CAS 134018-84-1) is a chemical compound with molecular formula C27H38O15 and molecular weight 602.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[3-[6-[[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-hydroxy-3-methylbutyl]-5,7-dimethoxychromen-2-one
Also Known As: Rubricauloside, 8-[3-[6-[[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-hydroxy-3-methylbutyl]-5,7-dimethoxychromen-2-one, 5,7-Dimethoxy-8-(2'-hydroxy-3'-methyl-3'-O-beta-D-apiofuranosyl(1-6)-beta-D-glucopyranosylbutyl)coumarin, 4-(5,7-Dimethoxy-2-oxo-2H-1-benzopyran-8-yl)-3-hydroxy-2-methylbutan-2-yl 6-O-[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]hexopyranoside, RefChem:180241
| Molecular Formula | C27H38O15 |
|---|---|
| Molecular Weight | 602.22 g/mol |
| LogP | -1.9 |
| Topological Polar Surface Area | 223.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 11 |
| Exact Mass | 602.22107 |
| Heavy Atoms | 42 |
| Complexity | 946.0 |
Chemical Identifiers
| CAS Number | 134018-84-1 |
|---|---|
| SMILES | CC(C)(C(CC1=C(C=C(C2=C1OC(=O)C=C2)OC)OC)O)OC3C(C(C(C(O3)COC4C(C(CO4)(CO)O)O)O)O)O |
| InChIKey | CKHYWBSGQWYTKJ-UHFFFAOYSA-N |
Product Overview
Rubricauloside (CAS 134018-84-1), with molecular formula C27H38O15 and molecular weight 602.22 g/mol. IUPAC: 8-[3-[6-[[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-hydroxy-3-methylbutyl]-5,7-dimethoxychromen-2-one.
Chemical Property Profile of Rubricauloside
Property Insights of Rubricauloside
The XLogP value of -1.9 indicates that Rubricauloside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 223.0 Ų indicates high polarity, suggesting Rubricauloside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Rubricauloside has 7 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Rubricauloside?
The CAS number of Rubricauloside is 134018-84-1.
What is the molecular formula of Rubricauloside?
The molecular formula of Rubricauloside is C27H38O15.
What is the molecular weight of Rubricauloside?
The molecular weight of Rubricauloside is 602.22 g/mol.
Where can I buy Rubricauloside?
You can request a quote for Rubricauloside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rubricauloside?
Yes, KEHONG BIO provides custom synthesis services for Rubricauloside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.