Diginatigenin-3-O-beta-D-digitaloside
3-[3-(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy-12,14,16-trihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
Also Known As: ACMC-20lcjt|Diginatigenin-3-O-beta-D-digitaloside|4-[3-(3,5-dihydroxy-4-methoxy-6-methyl-oxan-2-yl)oxy-12,14,16-trihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-5H-furan-2-one|3-[3-(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy-12,14,16-trihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one|L-Tyrosine, 3-hydroxy-N-[2-(mercaptomethyl)-1-oxo-3-phenylpropyl]-|3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-12,14,16-trihydroxycard-20(22)-enolide
| Molecular Formula | C30H46O10 |
|---|---|
| Molecular Weight | 566.3091 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 566.3091 |
| Monoisotopic Mass | 566.3091 |
| Heavy Atoms | 40 |
| Complexity | 1030.0 |
Chemical Identifiers
| CAS Number | 88660-35-9 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CC(C5(C4(CC(C5C6=CC(=O)OC6)O)O)C)O)C)O)OC)O |
| InChIKey | FAAUXNJCOFXHBZ-UHFFFAOYSA-N |
Product Overview
Diginatigenin-3-O-beta-D-digitaloside (CAS 88660-35-9), with molecular formula C30H46O10 and molecular weight 566.3091 g/mol. IUPAC: 3-[3-(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy-12,14,16-trihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one.
Diginatigenin-3-O-beta-D-digitaloside is a custom synthesis product. We offer services from milligram to kilogram scale.
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