input word = C00034021

Metabolite InformationStructural formula
Name Lanceocrepidiaside A
Formula C21H30O9
Mw 426.18898256
CAS RN 851779-90-3
C_ID C00034021 ,
InChIKey YKICMEBPTWEZRW-BZRPEHQVNA-N
InChICode InChI=1S/C21H30O9/c1-8-11-4-3-10(7-28-21-18(26)17(25)16(24)14(6-22)29-21)15(11)19-12(5-13(8)23)9(2)20(27)30-19/h3,9,12-19,21-26H,4-7H2,1-2H3/t9-,12-,13+,14+,15-,16+,17-,18+,19-,21+/m0/s1
SMILES CC1=C2CC=C(COC3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2[C@H]2OC(=O)[C@@H](C)[C@@H]2C[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCrepidiastrum lanceolatum NAKAI Ref.
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OrganismCrepidiastrum lanceolatum NAKAI
ReferenceZidorn,Phytochem.,69,(2008),2270