皂皮酸
TL;DR: 皂皮酸 (CAS 631-01-6) is a chemical compound with molecular formula C30H46O5 and molecular weight 486.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
皂皮酸
(4aR,5R,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-9-formyl-5,10-dihydroxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Also Known As: Quillaic acid, quillaja sapogenin, Saponin bark extract, (+)-QUILLAIC ACID, Soapbark(saponaria)extract
| Molecular Formula | C30H46O5 |
|---|---|
| Molecular Weight | 486.33 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 486.33453 |
| Heavy Atoms | 35 |
| Complexity | 970.0 |
Chemical Identifiers
| CAS Number | 631-01-6 |
|---|---|
| SMILES | C[C@]12CC[C@@H]([C@@]([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(C[C@H]([C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)O)C)C)(C)C=O)O |
| InChIKey | MQUFAARYGOUYEV-UAWZMHPWSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
皂皮酸 (CAS 631-01-6), with molecular formula C30H46O5 and molecular weight 486.33 g/mol. IUPAC: (4aR,5R,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-9-formyl-5,10-dihydroxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid.
Chemical Property Profile of 皂皮酸
Property Insights of 皂皮酸
The XLogP value of 6.1 indicates that 皂皮酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 皂皮酸. Following Lipinski's Rule of Five, 皂皮酸 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 皂皮酸?
The CAS number of 皂皮酸 is 631-01-6.
What is the molecular formula of 皂皮酸?
The molecular formula of 皂皮酸 is C30H46O5.
What is the molecular weight of 皂皮酸?
The molecular weight of 皂皮酸 is 486.33 g/mol.
Where can I buy 皂皮酸?
You can request a quote for 皂皮酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 皂皮酸?
Yes, KEHONG BIO provides custom synthesis services for 皂皮酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.