Cucurbitacin R
TL;DR: Cucurbitacin R (CAS 55903-92-9) is a chemical compound with molecular formula C30H46O7 and molecular weight 518.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,8S,9R,10R,13R,14S,16R,17R)-17-[(2R)-2,6-dihydroxy-6-methyl-3-oxoheptan-2-yl]-2,16-dihydroxy-4,4,9,13,14-pentamethyl-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
Also Known As: Cucurbitacin R, 23,24-dihydrocucurbitacin D, Dihydrocucurbitacin D, Tetrahydrocucurbitacin I, Dihydroelatericin A
| Molecular Formula | C30H46O7 |
|---|---|
| Molecular Weight | 518.32 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 518.32434 |
| Heavy Atoms | 37 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 55903-92-9 |
|---|---|
| SMILES | C[C@@]12C[C@H]([C@@H]([C@]1(CC(=O)[C@@]3([C@H]2CC=C4[C@H]3C[C@@H](C(=O)C4(C)C)O)C)C)[C@](C)(C(=O)CCC(C)(C)O)O)O |
| InChIKey | ITMUUFDDBRYVNJ-VOKXYEOFSA-N |
Product Overview
Cucurbitacin R (CAS 55903-92-9), with molecular formula C30H46O7 and molecular weight 518.32 g/mol. IUPAC: (2S,8S,9R,10R,13R,14S,16R,17R)-17-[(2R)-2,6-dihydroxy-6-methyl-3-oxoheptan-2-yl]-2,16-dihydroxy-4,4,9,13,14-pentamethyl-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthrene-3,11-dione.
Chemical Property Profile of Cucurbitacin R
Property Insights of Cucurbitacin R
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cucurbitacin R. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cucurbitacin R. Following Lipinski's Rule of Five, Cucurbitacin R has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cucurbitacin R?
The CAS number of Cucurbitacin R is 55903-92-9.
What is the molecular formula of Cucurbitacin R?
The molecular formula of Cucurbitacin R is C30H46O7.
What is the molecular weight of Cucurbitacin R?
The molecular weight of Cucurbitacin R is 518.32 g/mol.
Where can I buy Cucurbitacin R?
You can request a quote for Cucurbitacin R directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cucurbitacin R?
Yes, KEHONG BIO provides custom synthesis services for Cucurbitacin R and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.