ARVENIN III
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 21579640
Name
ARVENIN III
IUPAC name
(2S,8S,9R,10R,13R,14S,16R,17R)-17-((R,E)-2,6-dihydroxy-6-methyl-3-oxohept-4-en-2-yl)-16-hydroxy-4,4,9,13,14-pentamethyl-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4,7,8,9,10,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthrene-3,11(2H)-dione
SMILES
C[C@@]12C[C@H]([C@@H]([C@]1(CC(=O)[C@@]3([C@H]2CC=C4[C@H]3C[C@@H](C(=O)C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C)C)[C@](C)(C(=O)/C=C/C(C)(C)O)O)O
Molecular formula
C36H54O12
Molecular weight
678.82 g/mol
Monoisotopic mass
678.3615 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Lysimachia arvensis (L.) U.Manns & Anderb. | - | - |
Yamada, Y., Hagiwara, K., Iguchi, K., Suzuki, S., Hsu, H.Y. (1978). Isolation and structures of arvenins from Anagallis arvensis (Primulaceae). new cucurbitacin glucosides. Chem Pharm Bull, 26, 3107 doi:10.1248/cpb.26.3107
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