input word = C00025510

Metabolite InformationStructural formula
Name Holarosine B
Formula C30H47NO6
Mw 517.34033824
CAS RN 40738-38-3
C_ID C00025510 ,
InChIKey QLCJXHUAXDJDFZ-RYOMDWOCNA-N
InChICode InChI=1S/C30H47NO6/c1-17-27(31)24(34-4)15-26(36-17)37-20-7-10-28(2)19(14-20)5-6-23-22(28)8-11-29(3)21(9-12-30(23,29)33)18-13-25(32)35-16-18/h13,17,19-24,26-27,33H,5-12,14-16,31H2,1-4H3/t17-,19+,20+,21+,22+,23+,24-,26-,27+,28-,29-,30+/m1/s1
SMILES [C@]12([C@H]3CC[C@H]4C[C@H](CC[C@]4([C@H]3CC[C@@]1([C@@H](CC2)C1=CC(=O)OC1)C)C)O[C@@H]1C[C@H]([C@H]([C@H](O1)C)N)OC)O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeHolarrhena antidysenterica Ref.
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OrganismHolarrhena antidysenterica
ReferenceGoutarel,Carbohydr.Res.,24,(1972),297