HIPTAGIN

Structure

2D structure of HIPTAGIN
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 54037230

Names and identifiers

Name

HIPTAGIN

IUPAC name

(2S,3R,4S,5S,6R)-4-hydroxy-6-(((3-nitropropanoyl)oxy)methyl)tetrahydro-2H-pyran-2,3,5-triyl tris(3-nitropropanoate)

SMILES

C(C[N+](=O)[O-])C(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC(=O)CC[N+](=O)[O-])OC(=O)CC[N+](=O)[O-])O)OC(=O)CC[N+](=O)[O-]

General information

Molecular formula

C18H24N4O18

Molecular weight

584.40 g/mol

Monoisotopic mass

584.1086 Da

Classification

Pathway:
-
Superclass:
-
Class:
-
Glycoside:
Yes

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Securigera varia (L.) Lassen cell culture -
Moyer, B.G., Gustine, D.L. (1987). Esterification of 3-nitropropanoic acid to glucose by suspension cultures of Coronilla varia. Phytochemistry, 26(1), 139-140 doi:10.1016/s0031-9422(00)81497-1
Securigera varia (L.) Lassen seedling -
Moyer, B.G., Gustine, D.L. (1987). Esterification of 3-nitropropanoic acid to glucose by suspension cultures of Coronilla varia. Phytochemistry, 26(1), 139-140 doi:10.1016/s0031-9422(00)81497-1