ACACIIN
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Name
ACACIIN
IUPAC name
5-hydroxy-2-(4-methoxycyclohexyl)-7-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-((((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)octahydro-4H-chromen-4-one
SMILES
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3CC(C4C(=O)CC(OC4C3)C5CCC(CC5)OC)O)O)O)O)O)O)O
Molecular formula
C28H46O14
Molecular weight
606.66 g/mol
Monoisotopic mass
606.2888 Da
Pathway:
-
Superclass:
-
Class:
-
Glycoside:
Yes
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Linaria vulgaris Mill. subsp. vulgaris | - | - |
Wagner, H., Aurnhammer, G., Horhammer, L., Farkas, L. (1969). Acaetin glycosides. ii. identify comparison of asaciin from Robinia pseudoacia and linarin from Linaria vulgaris. Chem Ber, 102(5), 1445-1446
|
| Robinia pseudoacacia L. | leaf | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|