Hymatoxin A
TL;DR: Hymatoxin A (CAS 109621-33-2) is a chemical compound with molecular formula C20H29O7S- and molecular weight 413.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1S,2R,5S,9R,12S,16R)-2-hydroxy-1,5,12-trimethyl-11-oxo-10-oxatetracyclo[7.6.1.02,7.012,16]hexadec-7-en-5-yl]ethyl sulfate
Also Known As: Hymatoxin A, 2-[(1S,2R,5S,9R,12S,16R)-2-hydroxy-1,5,12-trimethyl-11-oxo-10-oxatetracyclo[7.6.1.02,7.012,16]hexadec-7-en-5-yl]ethyl sulfate, 9-Hydroxy-18-oxo-6beta,13alpha-6,18-epoxypimar-7-en-16-yl sulfate, methyl (1S,4aS,5aS,6R,10aS)-5',6'-dimethoxy-1-methyl-2'-oxo-spiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-f]indolizine-6,3'-indoline]-4-carboxylate
| Molecular Formula | C20H29O7S- |
|---|---|
| Molecular Weight | 413.16 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 413.1634 |
| Heavy Atoms | 28 |
| Complexity | 817.0 |
Chemical Identifiers
| CAS Number | 109621-33-2 |
|---|---|
| SMILES | C[C@@]1(CC[C@]2(C(=C[C@@H]3[C@@H]4[C@@]2(CCC[C@@]4(C(=O)O3)C)C)C1)O)CCOS(=O)(=O)[O-] |
| InChIKey | ITEVFNFZADKMQH-QBUATURESA-M |
Product Overview
Hymatoxin A (CAS 109621-33-2), with molecular formula C20H29O7S- and molecular weight 413.16 g/mol. IUPAC: 2-[(1S,2R,5S,9R,12S,16R)-2-hydroxy-1,5,12-trimethyl-11-oxo-10-oxatetracyclo[7.6.1.02,7.012,16]hexadec-7-en-5-yl]ethyl sulfate.
Chemical Property Profile of Hymatoxin A
Property Insights of Hymatoxin A
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hymatoxin A. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Hymatoxin A. Following Lipinski's Rule of Five, Hymatoxin A has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hymatoxin A?
The CAS number of Hymatoxin A is 109621-33-2.
What is the molecular formula of Hymatoxin A?
The molecular formula of Hymatoxin A is C20H29O7S-.
What is the molecular weight of Hymatoxin A?
The molecular weight of Hymatoxin A is 413.16 g/mol.
Where can I buy Hymatoxin A?
You can request a quote for Hymatoxin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hymatoxin A?
Yes, KEHONG BIO provides custom synthesis services for Hymatoxin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.