input word = C00025505

Metabolite InformationStructural formula
Name Holantosine F
Formula C28H45NO5
Mw 475.32977355
CAS RN 40738-41-8
C_ID C00025505 ,
InChIKey WBFUKUDNJLPCFA-XJLLLPIXNA-N
InChICode InChI=1S/C28H45NO5/c1-16-24(29)21(30-4)14-23(32-16)33-18-7-10-25(2)17(13-18)5-6-20-19(25)8-11-27-15-31-26(3)22(27)9-12-28(20,27)34-26/h16-24H,5-15,29H2,1-4H3/t16-,17+,18+,19-,20-,21-,22-,23-,24+,25-,26+,27+,28+/m1/s1
SMILES O1[C@]2([C@@H]3[C@]4(CC[C@H]5[C@]6([C@H](C[C@H](CC6)O[C@@H]6C[C@H]([C@H]([C@H](O6)C)N)OC)CC[C@H]5[C@]14CC3)C)CO2)C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeHolarrhena antidysenterica Ref.
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