input word = C00027714

Metabolite InformationStructural formula
Name 1-O-(3-Hydroxybutyryl)pancratistatin
Formula C18H21NO10
Mw 411.1165459
CAS RN 212953-15-6
C_ID C00027714 ,
InChIKey ZHHCZHUMIUUUGR-HVWZOMHENA-N
InChICode InChI=1S/C18H21NO10/c1-5(20)2-8(21)29-17-9-6-3-7-16(28-4-27-7)12(22)10(6)18(26)19-11(9)13(23)14(24)15(17)25/h3,5,9,11,13-15,17,20,22-25H,2,4H2,1H3,(H,19,26)/t5-,9+,11+,13-,14-,15+,17+/m0/s1
SMILES [C@H]1([C@H]2[C@H]([C@@H]([C@@H]([C@H]1O)O)O)NC(=O)c1c2cc2c(c1O)OCO2)OC(=O)C[C@H](C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeAmaryllidaceaeZephyranthes carinata Ref.
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