PRUNELLIN
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Name
PRUNELLIN
IUPAC name
(R)-2-phenyl-2-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)acetonitrile
SMILES
CC5CC(C4CCC1(C(=CCC2C1(CCC3C2(C(C(C(C3(C)C)O)O)O)C)C)C4C5C)C)C(=O)O
Molecular formula
C30H48O5
Molecular weight
488.71 g/mol
Monoisotopic mass
488.3502 Da
Pathway:
Superclass:
Class:
Glycoside:
No
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Prunella grandiflora (L.) Scholler | - | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|
| Prunella grandiflora (L.) Scholler | flower | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|
| Prunella vulgaris L. subsp. vulgaris | - | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|
| Prunella vulgaris L. subsp. vulgaris | flower | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|