input word = C00026531

Metabolite InformationStructural formula
Name Mollenine A
Formula C22H28N2O3
Mw 368.20999277
CAS RN 205693-72-7
C_ID C00026531 ,
InChIKey WEQVDRJVVSLJPA-QABAYDOMNA-N
InChICode InChI=1S/C22H28N2O3/c1-5-14(4)18-19(25)24-17(20(26)27-18)12-22(11-10-13(2)3)15-8-6-7-9-16(15)23-21(22)24/h6-10,14,17-18,21,23H,5,11-12H2,1-4H3/t14-,17-,18-,21+,22+/m1/s1
SMILES c1ccc2c(c1)[C@]1([C@@H](N2)N2[C@H](C1)C(=O)O[C@@H](C2=O)[C@@H](CC)C)CC=C(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeEupenicillium molle Ref.
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