input word = C00001573

Metabolite InformationStructural formula
Name Kalbreclasine
Formula C20H23NO12
Mw 469.12202521
CAS RN 98900-01-7
C_ID C00001573 ,
InChIKey SHDYPIISBMIEEN-DLOPMTBENA-N
InChICode InChI=1S/C20H23NO12/c22-3-9-13(24)16(27)17(28)20(33-9)32-7-2-6-5-1-8-18(31-4-30-8)14(25)10(5)19(29)21-11(6)15(26)12(7)23/h1-2,7,9,11-13,15-17,20,22-28H,3-4H2,(H,21,29)/t7-,9+,11+,12+,13+,15-,16-,17+,20-/m0/s1
SMILES c12c(c3c(cc1OCO2)C1=C[C@@H]([C@H]([C@H]([C@@H]1NC3=O)O)O)O[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeAmaryllidaceaeHaemanthus kalbreyeri Ref.
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