新藤黄酸
TL;DR: 新藤黄酸 (CAS 93772-31-7) 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.
新藤黄酸
(E)-4-[10,12-dihydroxy-8,21,21-trimethyl-5-(3-methylbut-2-enyl)-8-(4-methylpent-3-enyl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.02,15.02,19.04,13.06,11]docosa-4(13),5,11,15-tetraen-19-yl]-2-methylbut-2-enoic acid
Also Known As: Neogambogic acid, Neo-gambogic acid, Gambogenic Acid, NEOGAMBOGIC ACID (REFERENCE GRADE), 2-Dioleoyl-sn-glycero-3-phosphoethanolamine
| Molecular Formula | C38H46O9 |
|---|---|
| Molecular Weight | 646.31 g/mol |
| LogP | 6.6496 |
| Topological Polar Surface Area | 139.59 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 646.3142 |
| Heavy Atoms | 47 |
| Complexity | 1716.0409 |
Chemical Identifiers
| CAS Number | 93772-31-7 |
|---|---|
| SMILES | CC(=CCCC1(CC(C2=C(C3=C(C(=C2O1)CC=C(C)C)OC45C6CC(C=C4C3=O)C(=O)C5(OC6(C)C)C/C=C(\C)/C(=O)O)O)O)C)C |
Product Overview
新藤黄酸 (CAS 93772-31-7), with molecular formula C38H46O9 and molecular weight 646.31 g/mol. IUPAC: (E)-4-[10,12-dihydroxy-8,21,21-trimethyl-5-(3-methylbut-2-enyl)-8-(4-methylpent-3-enyl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.02,15.02,19.04,13.06,11]docosa-4(13),5,11,15-tetraen-19-yl]-2-methylbut-2-enoic acid.
Chemical Property Profile of 新藤黄酸
Property Insights of 新藤黄酸
The XLogP value of 6.6496 indicates that 新藤黄酸 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 新藤黄酸. Following Lipinski's Rule of Five, 新藤黄酸 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 新藤黄酸?
The CAS number of 新藤黄酸 is 93772-31-7.
What is the molecular formula of 新藤黄酸?
The molecular formula of 新藤黄酸 is C38H46O9.
What is the molecular weight of 新藤黄酸?
The molecular weight of 新藤黄酸 is 646.31 g/mol.
Where can I buy 新藤黄酸?
You can request a quote for 新藤黄酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 新藤黄酸?
Yes, KEHONG BIO provides custom synthesis services for 新藤黄酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.