Protoaescigenin
TL;DR: Protoaescigenin (CAS 13844-22-9) is a chemical compound with molecular formula C30H50O6 and molecular weight 506.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4a,9-bis(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-3,4,5,10-tetrol
Also Known As: Gymnemagenin, Protoaescigenin, Protoescigenin, Theasapogenol A, Protoescigenine
| Molecular Formula | C30H50O6 |
|---|---|
| Molecular Weight | 506.36 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 506.36075 |
| Heavy Atoms | 36 |
| Complexity | 932.0 |
Chemical Identifiers
| CAS Number | 13844-22-9 |
|---|---|
| SMILES | CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CC(C2(C(C1O)O)CO)O)C)C)(C)CO)O)C)C |
| InChIKey | VKJLHZZPVLQJKG-UHFFFAOYSA-N |
Product Overview
Protoaescigenin (CAS 13844-22-9), with molecular formula C30H50O6 and molecular weight 506.36 g/mol. IUPAC: 4a,9-bis(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-3,4,5,10-tetrol.
Chemical Property Profile of Protoaescigenin
Property Insights of Protoaescigenin
The XLogP value of 4.0 indicates that Protoaescigenin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Protoaescigenin. Following Lipinski's Rule of Five, Protoaescigenin has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Protoaescigenin?
The CAS number of Protoaescigenin is 13844-22-9.
What is the molecular formula of Protoaescigenin?
The molecular formula of Protoaescigenin is C30H50O6.
What is the molecular weight of Protoaescigenin?
The molecular weight of Protoaescigenin is 506.36 g/mol.
Where can I buy Protoaescigenin?
You can request a quote for Protoaescigenin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Protoaescigenin?
Yes, KEHONG BIO provides custom synthesis services for Protoaescigenin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.