51906-01-5
Product Name:
4a,7a-Epoxy-5H-cyclopenta[a]cyclopropa[f]cycloundecen-4(1H)-one, 2-(acetyloxy)-1a,2,3,6,7,10,11,11a-octahydro-7,10,11-trihydroxy-1,1,3,6,9-pentamethyl-, (1aR,2R,3R,4aR,6S,7S,7aS,8E,10R,11R,11aS)-
Formula:
C22H32O7
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 408.5 g/mol |
|---|---|
| XLogP3 | 0.5 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 2 |
| Exact Mass | 408.21480336 g/mol |
| Monoisotopic Mass | 408.21480336 g/mol |
| Topological Polar Surface Area | 117 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 788 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 10 |
| 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
Ingol-12-acetate is a natural product found in Euphorbia pekinensis with data available.