input word = C00014272

Metabolite InformationStructural formula
Name Anastatin A
(2S)-2,3-Dihydro-5,7,8-trihydroxy-2-(4-hydroxyphenyl)-4H-Benzofuro[3,2-g]-1-benzopyran-4-one
Formula C21H14O7
Mw 378.0739528
CAS RN 571186-32-8
C_ID C00014272 ,
InChIKey DBSPNTHFWOUQFX-GGYSOQFKNA-N
InChICode InChI=1S/C21H14O7/c22-10-3-1-9(2-4-10)15-7-14(25)20-18(27-15)8-17-19(21(20)26)11-5-12(23)13(24)6-16(11)28-17/h1-6,8,15,22-24,26H,7H2/t15-/m0/s1
SMILES O=C1C[C@@H](c2ccc(O)cc2)Oc2cc3oc4cc(O)c(O)cc4c3c(O)c21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeAnastatica hierochuntica Ref.
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