Pseudomorphine, tartrate
TL;DR: Pseudomorphine, tartrate (CAS 54479-55-9) is a chemical compound with molecular formula C38H42N2O12 and molecular weight 718.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydroxybutanedioic acid;10-(7,9-dihydroxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-10-yl)-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol
Also Known As: Pseudomorphine, Pseudomorphine, tartrate, Pseudomorphine tartrate, PSEUDOMORPHINE, TRIHYDRATE, 2,3-dihydroxybutanedioic acid; [dihydroxy(methyl)[?]yl]-methyl-[?]diol
| Molecular Formula | C38H42N2O12 |
|---|---|
| Molecular Weight | 718.27 g/mol |
| LogP | 0.254 |
| Topological Polar Surface Area | 221.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 4 |
| Exact Mass | 718.2738 |
| Heavy Atoms | 52 |
| Complexity | 1270.0 |
Chemical Identifiers
| CAS Number | 54479-55-9 |
|---|---|
| SMILES | CN1CCC23C4C1CC5=CC(=C(C(=C52)OC3C(C=C4)O)O)C6=C(C7=C8C(=C6)CC9C1C8(CCN9C)C(O7)C(C=C1)O)O.C(C(C(=O)O)O)(C(=O)O)O |
| InChIKey | JUBKRMDVUIPBKS-UHFFFAOYSA-N |
Product Overview
Pseudomorphine, tartrate (CAS 54479-55-9), with molecular formula C38H42N2O12 and molecular weight 718.27 g/mol. IUPAC: 2,3-dihydroxybutanedioic acid;10-(7,9-dihydroxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-10-yl)-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol.
Chemical Property Profile of Pseudomorphine, tartrate
Property Insights of Pseudomorphine, tartrate
The XLogP value of 0.254 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseudomorphine, tartrate. The TPSA of 221.0 Ų indicates high polarity, suggesting Pseudomorphine, tartrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pseudomorphine, tartrate has 8 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pseudomorphine, tartrate?
The CAS number of Pseudomorphine, tartrate is 54479-55-9.
What is the molecular formula of Pseudomorphine, tartrate?
The molecular formula of Pseudomorphine, tartrate is C38H42N2O12.
What is the molecular weight of Pseudomorphine, tartrate?
The molecular weight of Pseudomorphine, tartrate is 718.27 g/mol.
Where can I buy Pseudomorphine, tartrate?
You can request a quote for Pseudomorphine, tartrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudomorphine, tartrate?
Yes, KEHONG BIO provides custom synthesis services for Pseudomorphine, tartrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.