362472-81-9
Product Name:
WITHANOSIDEIV
Formula:
C40H62O15
Synonyms:
(1α,3β,22R)-3-[(6-O-β-D -Glucopyranosyl-β-D -glucopyranosyl)oxy]-1,22,27-trihydroxy-ergosta-5,24-dien-26-oic acid δ-lactone
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COMPUTED DESCRIPTORS
| Molecular Weight | 782.9 g/mol |
|---|---|
| XLogP3 | 1 |
| Hydrogen Bond Donor Count | 9 |
| Hydrogen Bond Acceptor Count | 15 |
| Rotatable Bond Count | 9 |
| Exact Mass | 782.40887127 g/mol |
| Monoisotopic Mass | 782.40887127 g/mol |
| Topological Polar Surface Area | 245 Ų |
| Heavy Atom Count | 55 |
| Formal Charge | 0 |
| Complexity | 1470 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 20 |
| 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
Withanoside IV is a natural product found in Withania somnifera with data available.