PULVERULENTOSIDE II

Structure

2D structure not available
2D structure
3D model not available
3D model

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

Names and identifiers

Name

PULVERULENTOSIDE II

IUPAC name

3-acetoxy-5-hydroxy-2-((1a-(hydroxymethyl)-2-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1a,1b,2,5a,6,6a-hexahydrooxireno[2',3':4,5]cyclopenta[1,2-c]pyran-6-yl)oxy)-6-methyltetrahydro-2H-pyran-4-yl (E)-3-(2-hydroxy-3-methoxyphenyl)acrylate

SMILES

C@H]1(O[C@@H]([C@H]([C@@H]([C@H]1O)OC(=O)/C=C/c1c(c(ccc1)OC)O)OC(=O)C)O[C@H]1[C@H]2[C@@H]([C@@]3([C@H]1O3)CO)[C@H](OC=C2)O[C@@H]1O[C@@H]([C@H]([C@H]([C@@H]1O)O)O)CO)C

General information

Molecular formula

C33H42O18

Molecular weight

726.68 g/mol

Monoisotopic mass

726.2400 Da

Classification

Pathway:
-
Superclass:
-
Class:
-

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

Plants with the compound

Plant Plant part Amount Reference
Scrophularia nodosa L. aerial parts -
Miyase, T., Mimatsu, A. (1999). Acylated iridoid and phenylethanoid glyucosides from the aerial parts of Scrophularia nodosa. J Nat Prod, 62(8), 1079-10184 doi:10.1021/np9805746