3epsilon-Hydroxyvobtusine
TL;DR: 3epsilon-Hydroxyvobtusine (CAS 65967-13-7) is a chemical compound with molecular formula C43H50N4O7 and molecular weight 734.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 18,24'-dihydroxy-19'-methoxyspiro[15-oxa-8,19-diazahexacyclo[10.9.1.01,9.02,7.012,16.019,22]docosa-2,4,6,9-tetraene-17,15'-8-oxa-4,17-diazaheptacyclo[11.10.1.11,4.07,11.017,24.018,23.011,25]pentacosa-18(23),19,21-triene]-10-carboxylate
Also Known As: 8-Hydroxyvobtusine, 3epsilon-Hydroxyvobtusine, 3.epsilon.-Hydroxyvobtusine, VOBTUSINE, (3E)-HYDROXY-
| Molecular Formula | C43H50N4O7 |
|---|---|
| Molecular Weight | 734.37 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 3 |
| Exact Mass | 734.3679 |
| Heavy Atoms | 54 |
| Complexity | 1710.0 |
Chemical Identifiers
| CAS Number | 65967-13-7 |
|---|---|
| SMILES | COC1=CC=CC2=C1N3CC4(CC5C3(C26CCN7C6C8(C5)CCOC8CC7)O)C9C1(CCO9)CC(=C2C3(C1N(C4O)CC3)C1=CC=CC=C1N2)C(=O)OC |
| InChIKey | HUWNUSVUJDHPHX-UHFFFAOYSA-N |
Product Overview
3epsilon-Hydroxyvobtusine (CAS 65967-13-7), with molecular formula C43H50N4O7 and molecular weight 734.37 g/mol. IUPAC: methyl 18,24'-dihydroxy-19'-methoxyspiro[15-oxa-8,19-diazahexacyclo[10.9.1.01,9.02,7.012,16.019,22]docosa-2,4,6,9-tetraene-17,15'-8-oxa-4,17-diazaheptacyclo[11.10.1.11,4.07,11.017,24.018,23.011,25]pentacosa-18(23),19,21-triene]-10-carboxylate.
Chemical Property Profile of 3epsilon-Hydroxyvobtusine
Property Insights of 3epsilon-Hydroxyvobtusine
The XLogP value of 3.5 indicates that 3epsilon-Hydroxyvobtusine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3epsilon-Hydroxyvobtusine. Following Lipinski's Rule of Five, 3epsilon-Hydroxyvobtusine has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3epsilon-Hydroxyvobtusine?
The CAS number of 3epsilon-Hydroxyvobtusine is 65967-13-7.
What is the molecular formula of 3epsilon-Hydroxyvobtusine?
The molecular formula of 3epsilon-Hydroxyvobtusine is C43H50N4O7.
What is the molecular weight of 3epsilon-Hydroxyvobtusine?
The molecular weight of 3epsilon-Hydroxyvobtusine is 734.37 g/mol.
Where can I buy 3epsilon-Hydroxyvobtusine?
You can request a quote for 3epsilon-Hydroxyvobtusine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3epsilon-Hydroxyvobtusine?
Yes, KEHONG BIO provides custom synthesis services for 3epsilon-Hydroxyvobtusine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.