MUSSAENOSIDIC ACID

Structure

2D structure of MUSSAENOSIDIC ACID
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 21633105

Names and identifiers

Name

MUSSAENOSIDIC ACID

IUPAC name

(1S,4aS,7S,7aS)-7-hydroxy-7-methyl-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid

SMILES

C[C@@]1(CC[C@H]2[C@@H]1[C@@H](OC=C2C(=O)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O

General information

Molecular formula

C16H24O10

Molecular weight

376.36 g/mol

Monoisotopic mass

376.1369 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Kickxia spuria (L.) Dumort. subsp. spuria aerial parts -
No reference