input word = C00028670

Metabolite InformationStructural formula
Name Neojerminalanine
(-)-Neojerminalanine
Neojerminalanine
Formula C39H61NO13
Mw 751.41429104
CAS RN 182693-36-3
C_ID C00028670 ,
InChIKey RCDFKDXMJYWZIU-SDWQQCRFNA-N
InChICode InChI=1S/C39H61NO13/c1-9-19(4)32(44)52-31-29(43)28-21(17-40-16-18(3)11-12-25(40)36(28,8)47)22-15-37-30(38(22,31)48)23(42)13-24-35(37,7)26(50-20(5)41)14-27(39(24,49)53-37)51-33(45)34(6,46)10-2/h18-19,21-31,42-43,46-49H,9-17H2,1-8H3/t18-,19-,21-,22-,23+,24-,25-,26-,27-,28+,29+,30+,31-,34-,35+,36+,37+,38-,39-/m0/s1
SMILES [C@@H]1(CC[C@@H]2N(C1)C[C@@H]1[C@@H]([C@]2(C)O)[C@H]([C@@H]([C@@]2([C@H]1C[C@@]13[C@H]2[C@@H](C[C@H]2[C@@]1([C@H](C[C@@H]([C@]2(O3)O)OC(=O)[C@](CC)(O)C)OC(=O)C)C)O)O)OC(=O)[C@H](CC)C)O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeMelanthiaceaeVeratrum album Ref.
PlantaeMelanthiaceaeVeratrum album L. Ref.
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