input word = C00030806

Metabolite InformationStructural formula
Name Neoazedarachin B
(-)-Neoazedarachin B
Formula C32H42O11
Mw 602.27271219
CAS RN 207447-74-3
C_ID C00030806 ,
InChIKey DZVAXADRXADLRZ-VWHYGROKNA-N
InChICode InChI=1S/C32H42O11/c1-14(2)27(39)43-28-30(5)19-10-20(35)31(6)24-18(34)9-17(16-7-8-40-12-16)29(24,4)26(38)23(37)25(31)32(19,13-41-28)21(36)11-22(30)42-15(3)33/h7-8,12,14,17,19-22,24-26,28,35-36,38H,9-11,13H2,1-6H3/t17-,19-,20+,21-,22+,24+,25-,26-,28-,29-,30+,31-,32+/m0/s1
SMILES CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](OC(=O)C(C)C)C1(C)[C@@H]2C[C@@H](O)[C@@]1(C)[C@@H]2C(=O)C[C@@H](c4ccoc4)[C@]2(C)[C@@H](O)C(=O)[C@@H]13
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeMelia azedarach Ref.
PlantaeMeliaceaeMelia toosendan Ref.
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