ISORHAMNETIN 3-RUTINOSIDE

Structure

2D structure of ISORHAMNETIN 3-RUTINOSIDE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 45933931

Names and identifiers

Name

ISORHAMNETIN 3-RUTINOSIDE

Also reported as

ISORHAMNETIN-3-O-RUTINOSIDE

IUPAC name

5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(((2S,4R,5S)-3,4,5-trihydroxy-6-((((2R,4R,5R)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one

SMILES

CC1[C@@H]([C@H](C([C@@H](O1)OCC2[C@H]([C@H](C([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)OC)O)O)O)O)O)O

General information

Molecular formula

C28H32O16

Molecular weight

624.55 g/mol

Monoisotopic mass

624.1690 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Acer negundo L. bark -
Backheet, E.Y., Enaam, Y. (2003). Gallotannin and flavonoid glycosides from the stem bark of Acer negundo L. Bull Pharm Sci Assiut Univ, 26(1), 77-82 doi:10.21608/bfsa.2003.65470
Larix decidua Mill. leaf -
Niemann, G.J., Baas, W.J. (1978). Phenolics from Larix needles. xiv. flavonoids and phenolic glucosides and ester of L. decidua. Z Naturforsch Ser C, 33, 780 doi:10.1515/znc-1978-9-1030
Parietaria officinalis L. flower -
Budzianowski, J., Skrzypczak, L., Walkowiak, D. (1985). Flavonoids of Parietaria officinalis. J Nat Prod, 48(2), 336-337 doi:10.1021/np50038a033
Primula veris L. subsp. columnae (Ten.) Maire & Petitm. flower -
Petitjean-freytat, C., Carnat, A., Lamaison, J.L. (1993). The primrose flower: comparative study on Primula veris L. and Primula elatior (L.) L. Plant Med Phytother, 26(1), 27-35
Senecio vulgaris L. subsp. vulgaris - -
Mansour, R.M.A., Saleh, N.A.M. (1981). Flavonoids of three local Senecio species. Phytochemistry, 20, 1180-1181 doi:10.1016/0031-9422(81)83066-x
Urtica dioica L. - 50 ppm
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.