(-)-5-Hydroxythalmine
TL;DR: (-)-5-Hydroxythalmine (CAS 115301-97-8) is a chemical compound with molecular formula C37H40N2O7 and molecular weight 624.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(12S,25S)-5,20,31-trimethoxy-11,26-dimethyl-2,18-dioxa-11,26-diazaheptacyclo[23.6.2.214,17.119,23.03,8.07,12.029,33]hexatriaconta-1(31),3(8),4,6,14(36),15,17(35),19,21,23(34),29,32-dodecaene-4,30-diol
Also Known As: 5-Hydroxythalmine, (-)-5-Hydroxythalmine, KST-1A0717, J2.417.687H, (12s,25s)-5,20,31-trimethoxy-11,26-dimethyl-2,18-dioxa-11,26-diazaheptacyclo[23.6.2.214,17.119,23.03,8.07,12.029,33]hexatriaconta-1(31),3,5,7,14,16,19(34),20,22,29,32,35-dodecaene-4,30-diol (non-preferred name)
| Molecular Formula | C37H40N2O7 |
|---|---|
| Molecular Weight | 624.28 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 624.28357 |
| Heavy Atoms | 46 |
| Complexity | 997.0 |
Chemical Identifiers
| CAS Number | 115301-97-8 |
|---|---|
| SMILES | CN1CCC2=C3C(=C(C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)C[C@H]6C7=CC(=C(C(=C7CCN6C)O)OC)O3)OC)OC)O |
| InChIKey | AJJJRLMIDHHVRN-VMPREFPWSA-N |
Product Overview
(-)-5-Hydroxythalmine (CAS 115301-97-8), with molecular formula C37H40N2O7 and molecular weight 624.28 g/mol. IUPAC: (12S,25S)-5,20,31-trimethoxy-11,26-dimethyl-2,18-dioxa-11,26-diazaheptacyclo[23.6.2.214,17.119,23.03,8.07,12.029,33]hexatriaconta-1(31),3(8),4,6,14(36),15,17(35),19,21,23(34),29,32-dodecaene-4,30-diol.
Chemical Property Profile of (-)-5-Hydroxythalmine
Property Insights of (-)-5-Hydroxythalmine
The XLogP value of 6.0 indicates that (-)-5-Hydroxythalmine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (-)-5-Hydroxythalmine. Following Lipinski's Rule of Five, (-)-5-Hydroxythalmine has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (-)-5-Hydroxythalmine?
The CAS number of (-)-5-Hydroxythalmine is 115301-97-8.
What is the molecular formula of (-)-5-Hydroxythalmine?
The molecular formula of (-)-5-Hydroxythalmine is C37H40N2O7.
What is the molecular weight of (-)-5-Hydroxythalmine?
The molecular weight of (-)-5-Hydroxythalmine is 624.28 g/mol.
Where can I buy (-)-5-Hydroxythalmine?
You can request a quote for (-)-5-Hydroxythalmine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (-)-5-Hydroxythalmine?
Yes, KEHONG BIO provides custom synthesis services for (-)-5-Hydroxythalmine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.