Rauvomitin
TL;DR: Rauvomitin (CAS 466-57-9) is a chemical compound with molecular formula C30H34N2O5 and molecular weight 502.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,10S,12R,13E,16S,17R)-13-ethylidene-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-trien-18-yl] 3,4,5-trimethoxybenzoate
Also Known As: Rauvomitin, [(1R,10S,12R,13E,16S,17R)-13-ethylidene-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-trien-18-yl] 3,4,5-trimethoxybenzoate, Ajmalan-17-ol, 19,20-didehydro-, 3,4,5-trimethoxybenzoate (ester), (17R,19E)-
| Molecular Formula | C30H34N2O5 |
|---|---|
| Molecular Weight | 502.25 g/mol |
| LogP | 4.0467 |
| Topological Polar Surface Area | 60.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 502.24677 |
| Heavy Atoms | 37 |
| Complexity | 1297.7952 |
Chemical Identifiers
| CAS Number | 466-57-9 |
|---|---|
| SMILES | C/C=C\1/CN2[C@H]3C[C@@H]1[C@@H]4[C@@H]2C[C@@]5(C3N(C6=CC=CC=C65)C)C4OC(=O)C7=CC(=C(C(=C7)OC)OC)OC |
Product Overview
Rauvomitin (CAS 466-57-9), with molecular formula C30H34N2O5 and molecular weight 502.25 g/mol. IUPAC: [(1R,10S,12R,13E,16S,17R)-13-ethylidene-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-trien-18-yl] 3,4,5-trimethoxybenzoate.
Chemical Property Profile of Rauvomitin
Property Insights of Rauvomitin
The XLogP value of 4.0467 indicates that Rauvomitin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Rauvomitin. Following Lipinski's Rule of Five, Rauvomitin has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Rauvomitin?
The CAS number of Rauvomitin is 466-57-9.
What is the molecular formula of Rauvomitin?
The molecular formula of Rauvomitin is C30H34N2O5.
What is the molecular weight of Rauvomitin?
The molecular weight of Rauvomitin is 502.25 g/mol.
Where can I buy Rauvomitin?
You can request a quote for Rauvomitin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rauvomitin?
Yes, KEHONG BIO provides custom synthesis services for Rauvomitin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.