input word = C00013454

Metabolite InformationStructural formula
Name Torosaflavone C
(5bR,8aS)-rel-4H,5b,8a-Dihydro-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-6-methyl-8H-cyclopenta[4,5]furo[3,2-g]-1-benzopyran-4,8-dione
Formula C22H16O8
Mw 408.08451749
CAS RN 144049-86-5
C_ID C00013454 ,
InChIKey JQIASYPXXAIEFJ-NOSZSVDRNA-N
InChICode InChI=1S/C22H16O8/c1-8-16-18-15(30-22(16)21(27)19(8)25)7-14-17(20(18)26)11(24)6-13(29-14)9-3-4-12(28-2)10(23)5-9/h3-7,16,22-23,25-26H,1-2H3/t16-,22+/m0/s1
SMILES c12c(cc3c(c1O)[C@H]1[C@@H](O3)C(=O)C(=C1C)O)oc(cc2=O)c1cc(c(cc1)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCassia torosa Ref.
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