白桦脂酸
TL;DR: 白桦脂酸 (CAS 472-15-1) is a chemical compound with molecular formula C30H48O3 and molecular weight 456.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
白桦脂酸
9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid
Also Known As: betulinic acid, Epibetulinic acid, Mairin, Betulic acid, 3-Epibetulinic acid
| Molecular Formula | C30H48O3 |
|---|---|
| Molecular Weight | 456.36 g/mol |
| LogP | 8.2 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 456.36035 |
| Heavy Atoms | 33 |
| Complexity | 861.0 |
Chemical Identifiers
| CAS Number | 472-15-1 |
|---|---|
| SMILES | CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)O |
| InChIKey | QGJZLNKBHJESQX-UHFFFAOYSA-N |
Product Overview
白桦脂酸 (CAS 472-15-1), with molecular formula C30H48O3 and molecular weight 456.36 g/mol. IUPAC: 9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid.
Chemical Property Profile of 白桦脂酸
Property Insights of 白桦脂酸
The XLogP value of 8.2 indicates that 白桦脂酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, 白桦脂酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 白桦脂酸 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 白桦脂酸?
The CAS number of 白桦脂酸 is 472-15-1.
What is the molecular formula of 白桦脂酸?
The molecular formula of 白桦脂酸 is C30H48O3.
What is the molecular weight of 白桦脂酸?
The molecular weight of 白桦脂酸 is 456.36 g/mol.
Where can I buy 白桦脂酸?
You can request a quote for 白桦脂酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 白桦脂酸?
Yes, KEHONG BIO provides custom synthesis services for 白桦脂酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.