input word = C00037459

Metabolite InformationStructural formula
Name Macrocentridine
Formula C23H37NO7
Mw 439.25700254
CAS RN 121747-79-3
C_ID C00037459 ,
InChIKey OLEIIQFNFBXIQS-UHFFFAOYNA-N
InChICode InChI=1S/C23H37NO7/c1-4-24-9-20(10-30-2)6-5-14(26)22-12-7-11-13(25)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14-,15-,16-,17+,18+,19-,20-,21-,22-,23+/m1/s1
SMILES [C@@]12([C@@H]3N(C[C@@]4([C@@H]([C@@]3([C@@H]3C[C@@H]5[C@H](C[C@]2([C@H]3[C@@H]5O)O)O)[C@@H](CC4)O)[C@@H]1OC)COC)CC)O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Secologanin Cholesterol
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeDelphinium triste Ref.
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