(+)-O,O-Dimethyltubocurine
TL;DR: (+)-O,O-Dimethyltubocurine (CAS 2233-44-5) is a chemical compound with molecular formula C38H42N2O6 and molecular weight 622.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9,10,21,25-tetramethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaene
Also Known As: (+)-O,O-Dimethyltubocurine, hyatinin methochloride, Chondrocurine, O,O-dimethyl-, Tubocuraran, 6,6',7',12'-tetramethoxy-2,2'-dimethyl-, Tubocuraran, 6,6',7':12'-tetramethoxy-2,2'-dimethyl-
| Molecular Formula | C38H42N2O6 |
|---|---|
| Molecular Weight | 622.30 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 61.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 622.30426 |
| Heavy Atoms | 46 |
| Complexity | 979.0 |
Chemical Identifiers
| CAS Number | 2233-44-5 |
|---|---|
| SMILES | CN1CCC2=CC(=C3C=C2C1CC4=CC=C(C=C4)OC5=C6C(CC7=CC(=C(C=C7)OC)O3)N(CCC6=CC(=C5OC)OC)C)OC |
| InChIKey | BWFWPNFEEDTSFC-UHFFFAOYSA-N |
Product Overview
(+)-O,O-Dimethyltubocurine (CAS 2233-44-5), with molecular formula C38H42N2O6 and molecular weight 622.30 g/mol. IUPAC: 9,10,21,25-tetramethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaene.
Chemical Property Profile of (+)-O,O-Dimethyltubocurine
Property Insights of (+)-O,O-Dimethyltubocurine
The XLogP value of 6.7 indicates that (+)-O,O-Dimethyltubocurine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (+)-O,O-Dimethyltubocurine. Following Lipinski's Rule of Five, (+)-O,O-Dimethyltubocurine has 0 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 (+)-O,O-Dimethyltubocurine?
The CAS number of (+)-O,O-Dimethyltubocurine is 2233-44-5.
What is the molecular formula of (+)-O,O-Dimethyltubocurine?
The molecular formula of (+)-O,O-Dimethyltubocurine is C38H42N2O6.
What is the molecular weight of (+)-O,O-Dimethyltubocurine?
The molecular weight of (+)-O,O-Dimethyltubocurine is 622.30 g/mol.
Where can I buy (+)-O,O-Dimethyltubocurine?
You can request a quote for (+)-O,O-Dimethyltubocurine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+)-O,O-Dimethyltubocurine?
Yes, KEHONG BIO provides custom synthesis services for (+)-O,O-Dimethyltubocurine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.