input word = C00047210

Metabolite InformationStructural formula
Name Cyclobuxoxazine
Formula C27H46N2O2
Mw 430.35592873
CAS RN 3294-83-5
C_ID C00047210 ,
InChIKey PYUKAYSOPGHAEP-UHFFFAOYNA-N
InChICode InChI=1S/C27H46N2O2/c1-17(29(5)6)22-18(30)13-25(4)20-8-7-19-23(2)15-31-16-28-21(23)9-10-26(19)14-27(20,26)12-11-24(22,25)3/h17-22,28,30H,7-16H2,1-6H3/t17-,18+,19+,20+,21-,22+,23+,24+,25+,26+,27-/m0/s1
SMILES C1[C@]2([C@@H](NCO1)CC[C@@]13[C@@H]2CC[C@H]2[C@]1(CC[C@]1([C@@]2(C[C@H]([C@H]1[C@@H](N(C)C)C)O)C)C)C3)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Asp Cholesterol
Organism
Kingdom Family Species Reference
PlantaeBuxaceaeBuxus microphylla Sieb.et Zucc. Ref.
PlantaeBuxaceaeBuxus microphylla Sieb.et Zucc.var.suffruticosa Mak. Ref.
PlantaeBuxaceaeBuxus nicrophylla Ref.
zoom in



OrganismBuxus microphylla Sieb.et Zucc.var.suffruticosa Mak.
ReferenceNakano,Tetrahedron Lett.,(1964),1034

Nakano,J.Chem.Soc.,C,(1966),1412