input word = C00063749

Metabolite InformationStructural formula
Name Hydroxymyoscorpine
Formula C20H31NO7
Mw 397.21005235
CAS RN 126642-92-0
C_ID C00063749
InChIKey HRSGCYGUWHGOPY-OCOMMVLDSA-N
InChICode InChI=1S/C20H31NO7/c1-6-12(2)17(23)28-15-8-10-21-9-7-14(16(15)21)11-27-18(24)20(26,13(3)22)19(4,5)25/h6-7,13,15-16,22,25-26H,8-11H2,1-5H3/b12-6+/t13-,15-,16-,20+/m1/s1
SMILES CC=C(C)C(=O)OC1CCN2CC=C(COC(=O)C(O)(C(C)O)C(C)(C)O)C12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBoraginaceaeLithospermum erythrorhizon Ref.
zoom in