TARAXASTEROL-PALMITATE

Structure

2D structure of TARAXASTEROL-PALMITATE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 14055767

Names and identifiers

Name

TARAXASTEROL-PALMITATE

IUPAC name

(3S,4aR,6aR,6bR,8aR,12S,12aR,12bR,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylenedocosahydropicen-3-yl palmitate

SMILES

C[C@H]5[C@@H]4[C@H]3CC[C@@H]2[C@]1(CC[C@@H](C([C@@H]1CC[C@]2([C@@]3(CC[C@]4(CCC5=C)C)C)C)(C)C)OC(CCCCCCCCCCCCCCC)=O)C

General information

Molecular formula

C46H80O2

Molecular weight

665.14 g/mol

Monoisotopic mass

664.6158 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Arctium lappa L. leaf -
Jim Duke's personal files.