直杉酸
TL;DR: 直杉酸 (CAS 86632-20-4) is a chemical compound with molecular formula C30H48O5 and molecular weight 488.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
直杉酸
(1R,5R,8S,11R,13R,14S,17R,18S,20R,21R,24R)-20,21-dihydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo[19.2.1.01,18.04,17.05,14.08,13]tetracosane-11-carboxylic acid
Also Known As: Orthosphenic acid, (2R,3R,5aR,7bR,9aS,12R,13aR,13bS,15aR,15bS,16R)-2,3-Dihydroxy-7b,9a,12,13b,15a,16-hexamethylicosahydro-5H-3,5a-methanochryseno[2,1-c]oxepine-12-carboxylic acid, 2,3-Dihydroxy-7b,9a,12,13b,15a,16-hexamethylicosahydro-5H-3,5a-methanochryseno[2,1-c]oxepine-12-carboxylic acid
| Molecular Formula | C30H48O5 |
|---|---|
| Molecular Weight | 488.35 g/mol |
| LogP | 5.6223 |
| Topological Polar Surface Area | 86.99 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 488.3502 |
| Heavy Atoms | 35 |
| Complexity | 951.0314 |
Chemical Identifiers
| CAS Number | 86632-20-4 |
|---|---|
| SMILES | C[C@@H]1[C@@]23CCC4[C@]([C@@H]2C[C@H]([C@@]1(OC3)O)O)(CC[C@@]5([C@@]4(CC[C@@]6([C@H]5C[C@](CC6)(C)C(=O)O)C)C)C)C |
Product Overview
直杉酸 (CAS 86632-20-4), with molecular formula C30H48O5 and molecular weight 488.35 g/mol. IUPAC: (1R,5R,8S,11R,13R,14S,17R,18S,20R,21R,24R)-20,21-dihydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo[19.2.1.01,18.04,17.05,14.08,13]tetracosane-11-carboxylic acid.
Chemical Property Profile of 直杉酸
Property Insights of 直杉酸
The XLogP value of 5.6223 indicates that 直杉酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 直杉酸. Following Lipinski's Rule of Five, 直杉酸 has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 直杉酸?
The CAS number of 直杉酸 is 86632-20-4.
What is the molecular formula of 直杉酸?
The molecular formula of 直杉酸 is C30H48O5.
What is the molecular weight of 直杉酸?
The molecular weight of 直杉酸 is 488.35 g/mol.
Where can I buy 直杉酸?
You can request a quote for 直杉酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 直杉酸?
Yes, KEHONG BIO provides custom synthesis services for 直杉酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.