Cucurbitacin H
TL;DR: Cucurbitacin H (CAS 751-95-1) is a chemical compound with molecular formula C30H46O8 and molecular weight 534.32 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)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-17-[(2R)-2,5,6-trihydroxy-6-methyl-3-oxoheptan-2-yl]-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
Also Known As: Cucurbitacin H, cucurbitacin G, 24-epi-Cucurbitacin G, (2S,8S,9R,10R,13R,14S,16R,17R)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-17-[(2R)-2,5,6-trihydroxy-6-methyl-3-oxoheptan-2-yl]-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthrene-3,11-dione, (10alpha)-2beta,16alpha,20,24,25-Pentahydroxy-9beta-methyl-19-norlanost-5-ene-3,11,22-trione
| Molecular Formula | C30H46O8 |
|---|---|
| Molecular Weight | 534.32 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 534.3193 |
| Heavy Atoms | 38 |
| Complexity | 1090.0 |
Chemical Identifiers
| CAS Number | 751-95-1 |
|---|---|
| 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)CC(C(C)(C)O)O)O)O |
| InChIKey | ABNDMUIXCBUBLO-REQJDAJISA-N |
Product Overview
Cucurbitacin H (CAS 751-95-1), with molecular formula C30H46O8 and molecular weight 534.32 g/mol. IUPAC: (2S,8S,9R,10R,13R,14S,16R,17R)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-17-[(2R)-2,5,6-trihydroxy-6-methyl-3-oxoheptan-2-yl]-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthrene-3,11-dione.
Chemical Property Profile of Cucurbitacin H
Property Insights of Cucurbitacin H
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cucurbitacin H. The TPSA of 152.0 Ų indicates high polarity, suggesting Cucurbitacin H may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cucurbitacin H has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cucurbitacin H?
The CAS number of Cucurbitacin H is 751-95-1.
What is the molecular formula of Cucurbitacin H?
The molecular formula of Cucurbitacin H is C30H46O8.
What is the molecular weight of Cucurbitacin H?
The molecular weight of Cucurbitacin H is 534.32 g/mol.
Where can I buy Cucurbitacin H?
You can request a quote for Cucurbitacin H directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cucurbitacin H?
Yes, KEHONG BIO provides custom synthesis services for Cucurbitacin H and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.