input word = C00025002

Metabolite InformationStructural formula
Name Spirasine III
9-Hydroxyspiredine
Formula C22H27NO4
Mw 369.19400836
CAS RN 112496-48-7
C_ID C00025002 ,
InChIKey QZDAJKZVNUERPG-UHFFFAOYNA-N
InChICode InChI=1S/C22H27NO4/c1-11-9-20-10-14(24)15-19(2)4-3-5-21(15)16(23-6-7-27-18(19)23)13(20)8-12(11)17(25)22(20,21)26/h12-13,15-16,18,26H,1,3-10H2,2H3/t12-,13-,15-,16-,18+,19+,20+,21+,22+/m1/s1
SMILES [C@]123CC(=O)[C@H]4[C@]56[C@@]1(C(=O)[C@@H](C(=C)C2)C[C@@H]3[C@H]5N1[C@H]([C@]4(CCC6)C)OCC1)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Asp Cholesterol
Organism
Kingdom Family Species Reference
PlantaeRosaceaeSpiraea japonica Ref.
PlantaeRosaceaeSpiraea japonica var.glabra Ref.
zoom in