藤黄酸
TL;DR: 藤黄酸 (CAS 7567-00-2) is a chemical compound with molecular formula C38H46O9 and molecular weight 646.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
藤黄酸
(4R)-4-[(E)-3-carboxybut-2-enyl]-14-hydroxy-6,6,18-trimethyl-21-(3-methylbut-2-enyl)-18-(4-methylpent-3-enyl)-12-oxo-2,5,19-trioxapentacyclo[11.8.0.03,7.03,11.015,20]henicosa-1(13),10,14,16,20-pentaene-4-carboxylic acid
Also Known As: GARCINOLIC ACID, garcinolic acid, trans-, Spectrum5_000026, SPECTRUM201539, KBio3_001745
| Molecular Formula | C38H46O9 |
|---|---|
| Molecular Weight | 646.31 g/mol |
| LogP | 7.5151 |
| Topological Polar Surface Area | 139.59 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 646.3142 |
| Heavy Atoms | 47 |
| Complexity | 1695.2181 |
Chemical Identifiers
| CAS Number | 7567-00-2 |
|---|---|
| SMILES | CC(=CCCC1(C=CC2=C(C3=C(C(=C2O1)CC=C(C)C)OC45C(CCC=C4C3=O)C(O[C@@]5(C/C=C(\C)/C(=O)O)C(=O)O)(C)C)O)C)C |
Product Overview
藤黄酸 (CAS 7567-00-2), with molecular formula C38H46O9 and molecular weight 646.31 g/mol. IUPAC: (4R)-4-[(E)-3-carboxybut-2-enyl]-14-hydroxy-6,6,18-trimethyl-21-(3-methylbut-2-enyl)-18-(4-methylpent-3-enyl)-12-oxo-2,5,19-trioxapentacyclo[11.8.0.03,7.03,11.015,20]henicosa-1(13),10,14,16,20-pentaene-4-carboxylic acid.
Chemical Property Profile of 藤黄酸
Property Insights of 藤黄酸
The XLogP value of 7.5151 indicates that 藤黄酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 藤黄酸. Following Lipinski's Rule of Five, 藤黄酸 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 藤黄酸?
The CAS number of 藤黄酸 is 7567-00-2.
What is the molecular formula of 藤黄酸?
The molecular formula of 藤黄酸 is C38H46O9.
What is the molecular weight of 藤黄酸?
The molecular weight of 藤黄酸 is 646.31 g/mol.
Where can I buy 藤黄酸?
You can request a quote for 藤黄酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 藤黄酸?
Yes, KEHONG BIO provides custom synthesis services for 藤黄酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.