C26H33NO9S
TL;DR: C26H33NO9S (CAS 66568-82-9) is a chemical compound with molecular formula C26H33NO9S and molecular weight 535.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3-trimethoxy-10-methylsulfanyl-7-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]-6,7-dihydro-5H-benzo[a]heptalen-9-one
Also Known As: Colchicine, N-deacetyl-10-demethoxy-N-(beta-d-glucopyranosyl)-10-(methylthio)-, Benzo(a)heptalen-9(5H)-one, 7-(beta-D-glucopyranosylamino)-6,7-dihydro-1,2,3-trimethoxy-10-(methylthio)-, (S)-, 1,2,3-trimethoxy-10-methylsulfanyl-7-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]-6,7-dihydro-5H-benzo[a]heptalen-9-one
| Molecular Formula | C26H33NO9S |
|---|---|
| Molecular Weight | 535.19 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 172.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 535.1876 |
| Heavy Atoms | 37 |
| Complexity | 924.0 |
Chemical Identifiers
| CAS Number | 66568-82-9 |
|---|---|
| SMILES | COC1=C(C(=C2C(=C1)CCC(C3=CC(=O)C(=CC=C32)SC)NC4C(C(C(C(O4)CO)O)O)O)OC)OC |
| InChIKey | ACIAPWKOTHFOAA-UHFFFAOYSA-N |
Product Overview
C26H33NO9S (CAS 66568-82-9), with molecular formula C26H33NO9S and molecular weight 535.19 g/mol. IUPAC: 1,2,3-trimethoxy-10-methylsulfanyl-7-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]-6,7-dihydro-5H-benzo[a]heptalen-9-one.
Chemical Property Profile of C26H33NO9S
Property Insights of C26H33NO9S
The XLogP value of -0.2 indicates that C26H33NO9S is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 172.0 Ų indicates high polarity, suggesting C26H33NO9S may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C26H33NO9S has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C26H33NO9S?
The CAS number of C26H33NO9S is 66568-82-9.
What is the molecular formula of C26H33NO9S?
The molecular formula of C26H33NO9S is C26H33NO9S.
What is the molecular weight of C26H33NO9S?
The molecular weight of C26H33NO9S is 535.19 g/mol.
Where can I buy C26H33NO9S?
You can request a quote for C26H33NO9S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C26H33NO9S?
Yes, KEHONG BIO provides custom synthesis services for C26H33NO9S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.