INGENOL,5-DEOXY

Structure

2D structure of INGENOL,5-DEOXY
2D structure
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3D model

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

Names and identifiers

Name

INGENOL,5-DEOXY

IUPAC name

(1aR,2S,5aR,6S,8aS,9R,10aR)-5a,6-dihydroxy-4-(hydroxymethyl)-1,1,7,9-tetramethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one

SMILES

C[C@@H]2C[C@@H]1[C@@H](C1(C)C)[C@@H]3C=C(C([H])[C@]4([C@@]2(C3=O)C=C([C@@H]4O)C)O)CO

General information

Molecular formula

C20H28O4

Molecular weight

332.44 g/mol

Monoisotopic mass

332.1988 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Euphorbia peplus L. exudate -
No reference