input word = C00008684

Metabolite InformationStructural formula
Name Aurapin
Formula C23H26O10
Mw 462.15259705
CAS RN 76733-22-7
C_ID C00008684 ,
InChIKey OVZNTQPOKHRJIN-RNUCBQCCNA-N
InChICode InChI=1S/C23H26O10/c1-10-17(25)19(27)20(28)23(31-10)33-22-18(26)16-14(24)8-13(30-3)9-15(16)32-21(22)11-4-6-12(29-2)7-5-11/h4-10,17,19-25,27-28H,1-3H3/t10-,17+,19-,20-,21-,22+,23+/m1/s1
SMILES c1c(c2c(cc1OC)O[C@@H]([C@H](C2=O)O[C@@H]1O[C@@H]([C@@H]([C@H]([C@H]1O)O)O)C)c1ccc(cc1)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLamiaceaeAcinos alpinus Ref.
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