R-HOLOCALIN

Structure

2D structure of R-HOLOCALIN
2D structure
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3D model

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

Names and identifiers

Name

R-HOLOCALIN

IUPAC name

2-(3-hydroxyphenyl)-2-(((2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)acetonitrile

SMILES

C1=CC(=CC(=C1)O)C(C#N)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)CO)O)O)O

General information

Molecular formula

C14H17NO7

Molecular weight

311.29 g/mol

Monoisotopic mass

311.1005 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Sambucus nigra L. - -
Jeffery B. Harborne and H. Baxter, eds. 1983. Phytochemical Dictionary. A Handbook of Bioactive Compounds from Plants. Taylor & Frost, London. 791 pp.