Dihydroniloticin
TL;DR: Dihydroniloticin (CAS 115334-05-9) is a chemical compound with molecular formula C30H50O3 and molecular weight 458.376 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
17-[4-(3,3-dimethyloxiran-2-yl)-4-hydroxybutan-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: Dihydroniloticin, Compound NP-021292, (3S,5R,9R,10R,13S,14S,17S)-17-[(2S,4R)-4-[(2S)-3,3-dimethyloxiran-2-yl]-4-hydroxybutan-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol, 17-[4-(3,3-dimethyloxiran-2-yl)-4-hydroxybutan-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
Technical Specifications
| Molecular Formula | C30H50O3 |
| Molecular Weight | 458.376 g/mol |
| XLogP | 6.8 |
| Topological Polar Surface Area (TPSA) | 53.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 458.376 Da |
| Heavy Atoms | 33 |
| Complexity | 828.0 |
| SMILES | CC(CC(C1C(O1)(C)C)O)C2CCC3(C2(CCC4C3=CCC5C4(CCC(C5(C)C)O)C)C)C |
| InChIKey | UMTABACRBSGXGK-UHFFFAOYSA-N |
Chemical Property Profile of Dihydroniloticin
Property Insights of Dihydroniloticin
The XLogP value of 6.8 indicates that Dihydroniloticin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.0 Ų, Dihydroniloticin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihydroniloticin has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Dihydroniloticin?
The CAS number of Dihydroniloticin is 115334-05-9.
What is the molecular formula of Dihydroniloticin?
The molecular formula of Dihydroniloticin is C30H50O3.
What is the molecular weight of Dihydroniloticin?
The molecular weight of Dihydroniloticin is 458.376 g/mol.
Where can I buy Dihydroniloticin?
You can request a quote for Dihydroniloticin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dihydroniloticin?
Yes, CoreyChem provides custom synthesis services for Dihydroniloticin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.