input word = C00029790

Metabolite InformationStructural formula
Name Basilimoside
Formula C36H60O6
Mw 588.43898965
CAS RN 942591-88-0
C_ID C00029790 ,
InChIKey FNGFDRHLEQKDDQ-AYMSAYBPNA-N
InChICode InChI=1S/C36H60O6/c1-8-22(34(3,4)5)10-9-21(2)26-13-14-27-25-12-11-23-19-24(15-17-35(23,6)28(25)16-18-36(26,27)7)41-33-32(40)31(39)30(38)29(20-37)42-33/h9-11,21-22,24-33,37-40H,8,12-20H2,1-7H3/b10-9+/t21-,22+,24-,25-,26+,27-,28-,29+,30+,31-,32+,33+,35-,36+/m0/s1
SMILES C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2(C1)C)CC[C@]1([C@H]3CC[C@@H]1[C@H](/C=C/[C@@H](CC)C(C)(C)C)C)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeOcimum basilicum Ref.
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OrganismOcimum basilicum
ReferenceSiddiqui,Chem.Pharm.Bull.,55,(2007),516