input word = C00025308

Metabolite InformationStructural formula
Name 3,4-Flexinine
Flexinine
Formula C16H17NO4
Mw 287.11575804
CAS RN 509-88-6
C_ID C00025308 ,
InChIKey WWSZBGJLESQTHB-RLKAHUSENA-N
InChICode InChI=1S/C16H17NO4/c18-10-5-13-16(15-14(10)21-15)1-2-17(13)6-8-3-11-12(4-9(8)16)20-7-19-11/h3-4,10,13-15,18H,1-2,5-7H2/t10-,13-,14+,15+,16+/m1/s1
SMILES c12c(cc3c(c1)[C@@]14[C@H](N(C3)CC4)C[C@H]([C@H]3[C@@H]1O3)O)OCO2
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeAmaryllidaceaeAmmocharis tinneana Ref.
PlantaeAmaryllidaceaeBrunsvigia gregaria Ref.
PlantaeAmaryllidaceaeCrinum amabile Ref.
PlantaeAmaryllidaceaeCrinum asiaticum Linn. Ref.
PlantaeAmaryllidaceaeNerine flexuosa Ref.
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OrganismNerine flexuosa
ReferenceFales,J.Org.Chem.,26,(1961),181