input word = C00028464

Metabolite InformationStructural formula
Name Leroyine
Formula C22H35NO5
Mw 393.25152324
CAS RN 145249-70-3
C_ID C00028464 ,
InChIKey XBAVRWWMTJPXJW-UHFFFAOYNA-N
InChICode InChI=1S/C22H35NO5/c1-4-23-10-19(2)6-5-15(24)22-12-7-11-13(28-3)8-20(26,16(12)17(11)25)21(27,18(22)23)9-14(19)22/h11-18,24-27H,4-10H2,1-3H3/t11-,12-,13-,14-,15+,16-,17-,18-,19+,20-,21-,22-/m1/s1
SMILES N1(C[C@]2([C@@H]3[C@@]4([C@H]1[C@](C3)([C@@]1([C@@H]3[C@H]4C[C@H]([C@@H](C1)OC)[C@H]3O)O)O)[C@H](CC2)O)C)CC
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum napellus ssp.neomontanum Wulfen Gayer Ref.
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