input word = C00033403

Metabolite InformationStructural formula
Name Tashironin
Formula C22H26O6
Mw 386.17293856
CAS RN 153150-80-2
C_ID C00033403 ,
InChIKey BRRTVYWNYBLCAX-KTFSXQMTNA-N
InChICode InChI=1S/C22H26O6/c1-13-9-10-21(26)18(2)12-27-22(28-16(24)14-7-5-4-6-8-14)17(25)20(13,21)11-15(23)19(18,22)3/h4-8,13,17,25-26H,9-12H2,1-3H3/t13-,17+,18-,19-,20+,21-,22?/m1/s1
SMILES C[C@@H]1CC[C@@]2(O)[C@@]13CC(=O)[C@@]1(C)[C@@](OC(=O)c4ccccc4)(OC[C@@]21C)[C@H]3O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIlliciaceaeIllicium merrillianum Ref.
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