input word = C00063645

Metabolite InformationStructural formula
Name 6-Tigloyloxyhyoscyamine
Formula C22H29NO5
Mw 387.20457304
CAS RN 110024-59-4
C_ID C00063645
InChIKey OPGJHCLCUNWOSH-UHFFFAOYSA-N
InChICode InChI=1S/C22H29NO5/c1-4-14(2)21(25)28-20-11-16-10-17(12-19(20)23(16)3)27-22(26)18(13-24)15-8-6-5-7-9-15/h4-9,16-20,24H,10-13H2,1-3H3
SMILES CC=C(C)C(=O)OC1CC2CC(OC(=O)C(CO)c3ccccc3)CC1N2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeDatura ceratocaula Ref.
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