input word = C00034022

Metabolite InformationStructural formula
Name Lanceocrepidiaside B
(+)-Lanceocrepidiaside B
Formula C29H36O11
Mw 560.22576199
CAS RN 851779-91-4
C_ID C00034022 ,
InChIKey RXSKLDPLNDXENS-XOXNHSRTNA-N
InChICode InChI=1S/C29H36O11/c1-13-18-8-5-16(23(18)27-19(10-20(13)31)14(2)28(36)40-27)11-38-29-26(35)25(34)24(33)21(39-29)12-37-22(32)9-15-3-6-17(30)7-4-15/h3-7,14,19-21,23-27,29-31,33-35H,8-12H2,1-2H3/t14-,19-,20+,21+,23-,24+,25-,26+,27-,29+/m0/s1
SMILES CC1=C2CC=C(COC3O[C@H](COC(=O)Cc4ccc(O)cc4)[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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