葫芦素D
TL;DR: 葫芦素D (CAS 3877-86-9) is a chemical compound with molecular formula C30H44O7 and molecular weight 516.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
葫芦素D
17-(2,6-dihydroxy-6-methyl-3-oxohept-4-en-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 D, 23,24-dihydro-cucurbitacin D, 17-(2,6-dihydroxy-6-methyl-3-oxohept-4-en-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
| Molecular Formula | C30H44O7 |
|---|---|
| Molecular Weight | 516.31 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 516.3087 |
| Heavy Atoms | 37 |
| Complexity | 1100.0 |
Chemical Identifiers
| CAS Number | 3877-86-9 |
|---|---|
| SMILES | CC1(C2=CCC3C4(CC(C(C4(CC(=O)C3(C2CC(C1=O)O)C)C)C(C)(C(=O)C=CC(C)(C)O)O)O)C)C |
| InChIKey | SRPHMISUTWFFKJ-UHFFFAOYSA-N |
Product Overview
葫芦素D (CAS 3877-86-9), with molecular formula C30H44O7 and molecular weight 516.31 g/mol. IUPAC: 17-(2,6-dihydroxy-6-methyl-3-oxohept-4-en-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 葫芦素D
Property Insights of 葫芦素D
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 葫芦素D. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 葫芦素D. Following Lipinski's Rule of Five, 葫芦素D 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 葫芦素D?
The CAS number of 葫芦素D is 3877-86-9.
What is the molecular formula of 葫芦素D?
The molecular formula of 葫芦素D is C30H44O7.
What is the molecular weight of 葫芦素D?
The molecular weight of 葫芦素D is 516.31 g/mol.
Where can I buy 葫芦素D?
You can request a quote for 葫芦素D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 葫芦素D?
Yes, KEHONG BIO provides custom synthesis services for 葫芦素D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.