input word = C00025475

Metabolite InformationStructural formula
Name 20-Epikibataline
20-epi-Kibataline
Formula C23H35NO2
Mw 357.26677937
CAS RN 96443-60-6
C_ID C00025475 ,
InChIKey AENSHGKORGDOBI-LMUZJLHONA-N
InChICode InChI=1S/C23H35NO2/c1-14-18-7-8-20-17-6-5-15-13-16(24(3)4)9-11-22(15,2)19(17)10-12-23(18,20)21(25)26-14/h5,14,16-20H,6-13H2,1-4H3/t14-,16-,17-,18-,19+,20+,22+,23+/m1/s1
SMILES C[C@H]1OC(=O)[C@]23CC[C@H]4[C@@H](CC=C5C[C@H](N(C)C)CC[C@@]54C)[C@@H]2CC[C@H]13
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg L-Asp Cholesterol
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeParavallaris microphylla Ref.
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