input word = C00050174

Metabolite InformationStructural formula
Name N-Demethylholacurtine
(+)-N-Demethylholacurtine
Formula C28H47NO5
Mw 477.34542362
CAS RN 75521-88-9
C_ID C00050174 ,
InChIKey XNPZZOKPHOMJPJ-OWQFVQHUNA-N
InChICode InChI=1S/C28H47NO5/c1-16(30)20-10-13-28(31)22-7-6-18-14-19(34-24-15-23(32-5)25(29)17(2)33-24)8-11-26(18,3)21(22)9-12-27(20,28)4/h17-25,31H,6-15,29H2,1-5H3/t17-,18+,19+,20-,21+,22-,23-,24+,25-,26+,27-,28+/m1/s1
SMILES [C@@H]1([C@@H](C[C@@H](O[C@@H]1C)O[C@H]1CC[C@]2([C@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@@]1(CC[C@@H]2C(=O)C)O)C)C)OC)N
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeHolarrhena curtisii Ref.
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OrganismHolarrhena curtisii
ReferenceKam,J.Nat.Prod.,61,(1998),1332