RAFFINOSE

Structure

2D structure of RAFFINOSE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 10542

Names and identifiers

Name

RAFFINOSE

IUPAC name

(3R,4S,5S,6R)-2-(((2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)tetrahydrofuran-2-yl)oxy)-6-((((3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-3,4,5-triol

SMILES

C([C@@H]1[C@@H]([C@@H]([C@H](C(O1)OC[C@@H]2[C@H]([C@@H]([C@H](C(O2)O[C@]3([C@H]([C@@H]([C@H](O3)CO)O)O)CO)O)O)O)O)O)O)O

General information

Molecular formula

C18H32O16

Molecular weight

504.44 g/mol

Monoisotopic mass

504.1690 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Ballota nigra L. subsp. meridionalis (Bég.) Bég. root -
List, P.H. and Horhammer, L., Hager's Handbuch der Pharmazeutischen Praxis, Vols. 2-6, Springer-Verlag, Berlin, 1969-1979.
Corylus avellana L. seed -
List, P.H. and Horhammer, L., Hager's Handbuch der Pharmazeutischen Praxis, Vols. 2-6, Springer-Verlag, Berlin, 1969-1979.
Erodium cicutarium (L.) L'Hér. - -
Watt, J.M., Breyer-brandwijk, M.G. (1962). The medicinal and poisonous plants of southern and eastern Africa. 2nd ed, E. + S. livingstone, ltd., london.
Humulus lupulus L. fruit -
List, P.H. and Horhammer, L., Hager's Handbuch der Pharmazeutischen Praxis, Vols. 2-6, Springer-Verlag, Berlin, 1969-1979.
Robinia pseudoacacia L. seed 1 ppm
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Securigera varia (L.) Lassen leaf -
Kovac, P., Sovova, M., Ryznarova, M., Hojgr, R., Polach, J. (1986). Study on Coronilla varia L. viii. identification and determination of free oligosaccharides. Cesk Farm, 35(9), 399-403
Securigera varia (L.) Lassen root -
Kovac, P., Sovova, M., Ryznarova, M., Hojgr, R., Polach, J. (1986). Study on Coronilla varia L. viii. identification and determination of free oligosaccharides. Cesk Farm, 35(9), 399-403
Securigera varia (L.) Lassen seed -
Kovac, P., Sovova, M., Ryznarova, M., Hojgr, R., Polach, J. (1986). Study on Coronilla varia L. viii. identification and determination of free oligosaccharides. Cesk Farm, 35(9), 399-403
Triticum aestivum L. subsp. aestivum seed 3300 ppm
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Urtica dioica L. root -
Blaschek, W., Hansel, R., Keller, K., Reichling, J., Rimpler, H., and Schneider, G. eds. 1998. Hager's Handbuch der Pharmazeutischen Praxis, Auflage Band 2 (A-K), 909 pp., (L-Z), 858 pp. Springer-Verlag, Berlin.