Dihydrogrisorixin
TL;DR: Dihydrogrisorixin (CAS 92630-01-8) is a chemical compound with molecular formula C40H70O10 and molecular weight 710.50 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-[[2-[5-[5-(1,5-dihydroxy-2,4-dimethylhexyl)-3-methyloxolan-2-yl]-5-methyloxolan-2-yl]-7-methoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-9-yl]methyl]-3-methyloxan-2-yl]propanoic acid
Also Known As: Dihydrogrisorixin, Nigericin, 25,29-deepoxy-30-deoxy-25-hydroxy-, Nigericin,25,29-deepoxy-30-deoxy-25-hydroxy-(9CI), Nigericin,25,29-deepoxy-30-deoxy-25-hydroxy- (9CI), 2-[6-({2-[5'-(1,5-dihydroxy-2,4-dimethylhexyl)-2,3'-dimethyloctahydro-2,2'-bifuran-5-yl]-9-methoxy-2,4,10-trimethyl-1,6-dioxaspiro[4.5]dec-7-yl}methyl)-3-methyltetrahydro-2h-pyran-2-yl]propanoic acid
| Molecular Formula | C40H70O10 |
|---|---|
| Molecular Weight | 710.50 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 710.4969 |
| Heavy Atoms | 50 |
| Complexity | 1150.0 |
Chemical Identifiers
| CAS Number | 92630-01-8 |
|---|---|
| SMILES | CC1CCC(OC1C(C)C(=O)O)CC2CC(C(C3(O2)C(CC(O3)(C)C4CCC(O4)(C)C5C(CC(O5)C(C(C)CC(C)C(C)O)O)C)C)C)OC |
| InChIKey | DIKCYDIVLAXNHG-UHFFFAOYSA-N |
Product Overview
Dihydrogrisorixin (CAS 92630-01-8), with molecular formula C40H70O10 and molecular weight 710.50 g/mol. IUPAC: 2-[6-[[2-[5-[5-(1,5-dihydroxy-2,4-dimethylhexyl)-3-methyloxolan-2-yl]-5-methyloxolan-2-yl]-7-methoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-9-yl]methyl]-3-methyloxan-2-yl]propanoic acid.
Chemical Property Profile of Dihydrogrisorixin
Property Insights of Dihydrogrisorixin
The XLogP value of 6.3 indicates that Dihydrogrisorixin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dihydrogrisorixin. Following Lipinski's Rule of Five, Dihydrogrisorixin has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dihydrogrisorixin?
The CAS number of Dihydrogrisorixin is 92630-01-8.
What is the molecular formula of Dihydrogrisorixin?
The molecular formula of Dihydrogrisorixin is C40H70O10.
What is the molecular weight of Dihydrogrisorixin?
The molecular weight of Dihydrogrisorixin is 710.50 g/mol.
Where can I buy Dihydrogrisorixin?
You can request a quote for Dihydrogrisorixin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydrogrisorixin?
Yes, KEHONG BIO provides custom synthesis services for Dihydrogrisorixin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.