40158-95-0
Product Name:
(12ξ,13ξ)-12,13-Epoxy-19-hydroxysenecionan-11,16-dione
Formula:
C18H23NO6
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 349.4 g/mol |
|---|---|
| XLogP3 | -0.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 1 |
| Exact Mass | 349.15253745 g/mol |
| Monoisotopic Mass | 349.15253745 g/mol |
| Topological Polar Surface Area | 88.6 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 685 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
CID 6442624 is a natural product found in Jacobaea aquatica with data available.