158511-59-2
Product Name:
ECLALBASAPONIN I
Formula:
C42H68O14
Synonyms:
(3β,16α)-3-(β-D -Glucopyranosyloxy)-16-hydroxyolean-12-en-28-oic acid β-D -glucopyranosyl ester
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COMPUTED DESCRIPTORS
| Molecular Weight | 797.0 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 9 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 7 |
| Exact Mass | 796.46090684 g/mol |
| Monoisotopic Mass | 796.46090684 g/mol |
| Topological Polar Surface Area | 236 Ų |
| Heavy Atom Count | 56 |
| Formal Charge | 0 |
| Complexity | 1520 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 19 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Eclalbasaponin I is a natural product found in Eclipta alba and Eclipta prostrata with data available.