input word = C00051140

Metabolite InformationStructural formula
Name Kihadanin B
Formula C26H30O9
Mw 486.18898256
CAS RN 73793-68-7
C_ID C00051140
InChIKey LUSHRJRLUBDDTB-MUUIPRAHNA-N
InChICode InChI=1S/C26H30O9/c1-22(2)14-11-15(27)25(5)13(23(14,3)8-7-16(28)34-22)6-9-24(4)18(12-10-17(29)32-20(12)30)33-21(31)19-26(24,25)35-19/h7-8,10,13-14,17-19,29H,6,9,11H2,1-5H3/t13-,14+,17?,18+,19-,23-,24+,25+,26-/m1/s1
SMILES CC1(C)OC(=O)C=C[C@]2(C)[C@H]3CC[C@@]4(C)[C@H](C5=CC(O)OC5=O)OC(=O)[C@H]5O[C@]54[C@]3(C)C(=O)C[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeDictamnus dasycarpus Ref.
PlantaeRutaceaePhellodendron amurense Ref.
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