input word = C00041540

Metabolite InformationStructural formula
Name Ghalakinoside
Formula C29H42O11
Mw 566.27271219
CAS RN 119459-76-6
C_ID C00041540 ,
InChIKey NPHHLSOQKLWOCK-UHFFFAOYNA-N
InChICode InChI=1S/C29H42O11/c1-26-17(14-6-24(34)37-12-14)4-5-28(26,35)18-3-2-15-7-20-21(10-27(15,13-31)19(18)9-22(26)32)40-29(36)23(33)8-16(11-30)38-25(29)39-20/h6,15-23,25,30-33,35-36H,2-5,7-13H2,1H3/t15-,16+,17+,18+,19-,20-,21-,22+,23-,25-,26-,27-,28-,29+/m0/s1
SMILES C1[C@@H](O[C@@H]2[C@@]([C@H]1O)(O[C@@H]1[C@@H](O2)C[C@H]2[C@@](C1)([C@@H]1[C@@H](CC2)[C@@]2([C@]([C@@H](C1)O)([C@H](CC2)C1=CC(=O)OC1)C)O)CO)O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaePergularia tomentosa Ref.
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