input word = C00002272

Metabolite InformationStructural formula
Name Zygadenine
Formula C27H43NO7
Mw 493.30395274
CAS RN 545-45-9
C_ID C00002272 ,
InChIKey NPNDUIMQBJIGQS-PWYRXMOWNA-N
InChICode InChI=1S/C27H43NO7/c1-13-4-7-18-24(3,32)20-14(12-28(18)11-13)15-10-25-17(26(15,33)22(31)21(20)30)6-5-16-23(25,2)9-8-19(29)27(16,34)35-25/h13-22,29-34H,4-12H2,1-3H3/t13-,14-,15-,16-,17+,18-,19-,20+,21+,22-,23-,24+,25+,26-,27-/m0/s1
SMILES C1[C@@H]([C@@]2([C@@H]3[C@](C1)([C@@]1([C@@H](CC3)[C@]3([C@@H](C1)[C@H]1[C@H]([C@H]([C@@H]3O)O)[C@]([C@H]3N(C1)C[C@H](CC3)C)(C)O)O)O2)C)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp Cholesterol
Organism
Kingdom Family Species Reference
PlantaeFabaceaeAstragalus polycanthus Royle Ref.
PlantaeMelanthiaceaeVeratrum album Ref.
PlantaeMelanthiaceaeVeratrum maackii Ref.
PlantaeMelanthiaceaeVeratrum stenophyllum Ref.
PlantaeMelanthiaceaeZigadenus gramineus Ref.
PlantaeMelanthiaceaeZigadenus venenosus Ref.
--Zygadenus intermedius Ref.
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OrganismVeratrum album
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter29