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Concept information

... > organooxygen compound > oxacycle > furochromene > furanocoumarin > psoralens > (r)-rutaretin 1'-(6''-sinapoylglucoside)

Preferred term

(r)-rutaretin 1'-(6''-sinapoylglucoside)  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C31H34O14

inchi

  • InChI=1S/C31H34O14/c1-31(2,20-12-16-11-15-6-8-22(33)44-28(15)27(38)29(16)43-20)45-30-26(37)25(36)24(35)19(42-30)13-41-21(32)7-5-14-9-17(39-3)23(34)18(10-14)40-4/h5-11,19-20,24-26,30,34-38H,12-13H2,1-4H3/b7-5+

inchikey

  • IVHSSCUMYDHEGB-FNORWQNLSA-N

mass

  • 630.599

monoisotopicmass

  • 630.19486

smiles

  • O(C(C1OC2=C(C1)C=C3C(OC(=O)C=C3)=C2O)(C)C)C4OC(C(O)C(O)C4O)COC(=O)/C=C/C5=CC(OC)=C(O)C(OC)=C5

subset

  • 2_STAR

synonym EXACT

  • [3,4,5-trihydroxy-6-[2-(9-hydroxy-7-oxo-2,3-dihydrouro[3,2-g]chromen-2-yl)propan-2-yloxy]oxan-2-yl]methyl (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:168481

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