74627-72-8
Product Name:
2H,12H-6,12a-Epoxy-2,7a-methanoindolo[2,3-a]quinolizine-14-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-9,11-dimethoxy-, methyl ester, (2R,3E,6S,7aR,12aR,12bS,14R)- (9CI)
Formula:
C22H26N2O5
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 398.5 g/mol |
|---|---|
| XLogP3 | 2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 398.18417193 g/mol |
| Monoisotopic Mass | 398.18417193 g/mol |
| Topological Polar Surface Area | 69.3 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 772 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 6 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Tabernulosine is a natural product found in Tabernaemontana glandulosa with data available.