input word = C00028413

Metabolite InformationStructural formula
Name Isorubijervosine
Formula C33H53NO7
Mw 575.38220305
CAS RN 468-46-2
C_ID C00028413 ,
InChIKey PELDOJNAKPMYLQ-UHFFFAOYNA-N
InChICode InChI=1S/C33H53NO7/c1-17-4-7-24-18(2)27-25(34(24)14-17)13-23-21-6-5-19-12-20(40-31-30(39)29(38)28(37)26(15-35)41-31)8-10-32(19,3)22(21)9-11-33(23,27)16-36/h5,17-18,20-31,35-39H,4,6-16H2,1-3H3/t17-,18+,20+,21-,22+,23+,24-,25+,26-,27+,28-,29+,30-,31-,32+,33+/m1/s1
SMILES C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2(C1)C)CC[C@@]1([C@H]3C[C@H]2[C@@H]1[C@H]([C@@H]1N2C[C@@H](CC1)C)C)CO)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeMelanthiaceaeVeratrum escholtzii Ref.
PlantaeMelanthiaceaeVeratrum lobelianum Ref.
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