GRANATIN B
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 50903199
Name
GRANATIN B
IUPAC name
(57R,58S,510R,511R,517S)-14,15,16,24,25,26,51a,52,52,515,516-undecahydroxy-53,55,513,3,8-pentaoxo-51a,51a<sup>1</sup>,52,53,55,57,58,510,511,513-decahydro-51,56,59,512,4,7-hexaoxa-5(17,10)-1,6,9,12-tetraoxa-7,11-methanocyclotrideca[def]fluorena-1,2(1,2)-dibenzenacyclooctaphane-58-yl 3,4,5-trihydroxybenzoate
SMILES
C1[C@@H]2[C@@H]3[C@@H]([C@H]([C@@H](O2)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=O)C(C6(C5C7=C(O6)C(=C(C=C7C(=O)O3)O)O)O)(O)O)OC(=O)C8=CC(=C(C(=C8C9=C(C(=C(C=C9C(=O)O1)O)O)O)O)O)O
Molecular formula
C41H28O27
Molecular weight
952.65 g/mol
Monoisotopic mass
952.0818 Da
Pathway:
Superclass:
Class:
Glycoside:
Yes
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Euphorbia maculata L. | leaf | - |
Amakura, Y., Kawada, K., Hatano, T., Agata, I., Sugaya, T., Nishibe, S., Okuda, T., Yoshida, T. (1997). Four new hydrolyzable tannins and an acylated flavonol glycoside from Euphorbia maculata. Can J Chem, 75(6), 727-733 doi:10.1139/v97-088
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