Pleiatensin
TL;DR: Pleiatensin (CAS 1111-44-0) is a chemical compound with molecular formula C44H60N2O15 and molecular weight 856.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R)-2,3-dihydroxybutanedioic acid;methyl (1S,2R,3R,4aS,12bS,13aS)-12-[2-(diethylamino)ethyl]-2,10-dimethoxy-3-(3,4,5-trimethoxybenzoyl)oxy-1,2,3,4,4a,5,5a,6,7,12b,13,13a-dodecahydronaphtho[7,6-a]carbazole-1-carboxylate
Also Known As: Pleiatensin, Tensibar, Bietaserpine bitartrate, D. L. 152, 1-(2-(Diethylamino)ethyl)reserpine bitartrate
| Molecular Formula | C44H60N2O15 |
|---|---|
| Molecular Weight | 856.40 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 222.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 18 |
| Exact Mass | 856.39935 |
| Heavy Atoms | 61 |
| Complexity | 1270.0 |
Chemical Identifiers
| CAS Number | 1111-44-0 |
|---|---|
| SMILES | CCN(CC)CCN1C2=C(C=CC(=C2)OC)C3=C1[C@H]4C[C@H]5[C@H](C[C@H]([C@@H]([C@H]5C(=O)OC)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC)CC4CC3.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O |
| InChIKey | FIVIJZLAHKBGLP-PDHAJTERSA-N |
Product Overview
Pleiatensin (CAS 1111-44-0), with molecular formula C44H60N2O15 and molecular weight 856.40 g/mol. IUPAC: (2R,3R)-2,3-dihydroxybutanedioic acid;methyl (1S,2R,3R,4aS,12bS,13aS)-12-[2-(diethylamino)ethyl]-2,10-dimethoxy-3-(3,4,5-trimethoxybenzoyl)oxy-1,2,3,4,4a,5,5a,6,7,12b,13,13a-dodecahydronaphtho[7,6-a]carbazole-1-carboxylate.
Chemical Property Profile of Pleiatensin
Property Insights of Pleiatensin
The XLogP value of 4.0 indicates that Pleiatensin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 222.0 Ų indicates high polarity, suggesting Pleiatensin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pleiatensin has 4 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pleiatensin?
The CAS number of Pleiatensin is 1111-44-0.
What is the molecular formula of Pleiatensin?
The molecular formula of Pleiatensin is C44H60N2O15.
What is the molecular weight of Pleiatensin?
The molecular weight of Pleiatensin is 856.40 g/mol.
Where can I buy Pleiatensin?
You can request a quote for Pleiatensin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pleiatensin?
Yes, KEHONG BIO provides custom synthesis services for Pleiatensin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.