input word = C00033943

Metabolite InformationStructural formula
Name Hypochoeroside F
Formula C30H34O11
Mw 570.21011193
CAS RN 123693-90-3
C_ID C00033943 ,
InChIKey SNDLGLIELUBHKN-DXFHZIOJNA-N
InChICode InChI=1S/C30H34O11/c1-14-10-19(39-21(33)9-8-16-6-4-3-5-7-16)23-15(2)29(37)41-28(23)24-17(11-18(32)22(14)24)13-38-30-27(36)26(35)25(34)20(12-31)40-30/h3-9,11,14,19-20,22-28,30-31,34-36H,2,10,12-13H2,1H3/b9-8+/t14-,19-,20+,22-,23+,24-,25+,26-,27+,28+,30-/m0/s1
SMILES [C@H]12[C@@H]([C@H](C[C@@H]([C@@H]3[C@H]1OC(=O)C3=C)OC(=O)/C=C/c1ccccc1)C)C(=O)C=C2CO[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHypochaeris radicata L. Ref.
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