Diplopterol
TL;DR: Diplopterol (CAS 20684-29-1) is a chemical compound with molecular formula C30H52O and molecular weight 428.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3S,3aS,5aR,5bR,7aS,11aS,11bR,13aR,13bS)-5a,5b,8,8,11a,13b-hexamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysen-3-yl]propan-2-ol
Also Known As: Diplopterol, Hopan-22-ol, 22-Hydroxyhopane, Hydroxyhopane, 22-Hopanol
| Molecular Formula | C30H52O |
|---|---|
| Molecular Weight | 428.40 g/mol |
| LogP | 9.9 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 428.40182 |
| Heavy Atoms | 31 |
| Complexity | 737.0 |
Chemical Identifiers
| CAS Number | 20684-29-1 |
|---|---|
| SMILES | C[C@]12CC[C@@H]([C@@H]1CC[C@@]3([C@@H]2CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CCCC5(C)C)C)C)C)C(C)(C)O |
| InChIKey | PNJBOAVCVAVRGR-UDCAXGDQSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diplopterol (CAS 20684-29-1), with molecular formula C30H52O and molecular weight 428.40 g/mol. IUPAC: 2-[(3S,3aS,5aR,5bR,7aS,11aS,11bR,13aR,13bS)-5a,5b,8,8,11a,13b-hexamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysen-3-yl]propan-2-ol.
Chemical Property Profile of Diplopterol
Property Insights of Diplopterol
The XLogP value of 9.9 indicates that Diplopterol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Diplopterol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diplopterol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diplopterol?
The CAS number of Diplopterol is 20684-29-1.
What is the molecular formula of Diplopterol?
The molecular formula of Diplopterol is C30H52O.
What is the molecular weight of Diplopterol?
The molecular weight of Diplopterol is 428.40 g/mol.
Where can I buy Diplopterol?
You can request a quote for Diplopterol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diplopterol?
Yes, KEHONG BIO provides custom synthesis services for Diplopterol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.