input word = C00064199

Metabolite InformationStructural formula
Name Dehydroheliotrine
Formula C16H25NO5
Mw 311.17327292
CAS RN 23107-11-1
C_ID C00064199
InChIKey KYSOVPPHGLNVRV-ULKWEWGCSA-N
InChICode InChI=1S/C16H25NO5/c1-10(2)16(20,11(3)21-4)15(19)22-9-12-5-7-17-8-6-13(18)14(12)17/h5,7,10-11,13,18,20H,6,8-9H2,1-4H3/t11?,13-,16?/m0/s1
SMILES COC(C)C(O)(C(=O)OCc1ccn2c1C(O)CC2)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBoraginaceaeHeliotropium europaeum Ref.
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