input word = C00024989

Metabolite InformationStructural formula
Name Spiramine O
Formula C21H31NO3
Mw 345.23039386
CAS RN 137760-61-3
C_ID C00024989 ,
InChIKey NVVATEFXXWYTJP-VUHWIJLVNA-N
InChICode InChI=1S/C21H31NO3/c1-12-13-5-8-21(17(12)24)15(9-13)20-7-4-6-19(2,14(20)10-16(21)23)18(25-3)22-11-20/h11,13-18,23-24H,1,4-10H2,2-3H3/t13-,14+,15-,16+,17-,18+,19?,20+,21+/m0/s1
SMILES C1=N[C@H](OC)[C@@]2(CCC[C@@]31[C@@H]2C[C@H]([C@@]12[C@H](C(=C)[C@H](C[C@@H]32)CC1)O)O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Asp Cholesterol
Organism
Kingdom Family Species Reference
PlantaeRosaceaeSpiraea japonica var.acuminata Ref.
zoom in