input word = C00046390

Metabolite InformationStructural formula
Name Scorzocreticoside I
(-)-Scorzocreticoside I
Formula C22H24O10
Mw 448.13694699
CAS RN 393510-25-3
C_ID C00046390 ,
InChIKey CQQWKLDNRLSJJV-NICFLSEFNA-N
InChICode InChI=1S/C22H24O10/c1-29-13-4-2-10(3-5-13)14-7-11-6-12(24)8-15(17(11)21(28)30-14)31-22-20(27)19(26)18(25)16(9-23)32-22/h2-6,8,14,16,18-20,22-27H,7,9H2,1H3/t14-,16+,18+,19-,20+,22+/m0/s1
SMILES [C@@H]1([C@@H]([C@H]([C@@H](O[C@@H]1CO)Oc1cc(cc2c1C(=O)O[C@@H](C2)c1ccc(cc1)OC)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeScorzonera cretica Ref.
PlantaeAsteraceaeTragopogon porrifolius Ref.
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