input word = C00038439

Metabolite InformationStructural formula
Name Amotsangin B
(+)-Amotsangin B
Formula C33H42O10
Mw 598.27779756
CAS RN 1005007-14-6
C_ID C00038439 ,
InChIKey IGDXTIYJGIXWPU-FELFUAFXNA-N
InChICode InChI=1S/C33H42O10/c1-17(2)29(37)41-28-27(40-19(4)34)26(31(7)12-10-24(35)43-30(5,6)22(31)15-25(36)38-9)18(3)33-23(42-33)14-21(32(28,33)8)20-11-13-39-16-20/h10-13,16-17,21-23,26-28H,3,14-15H2,1-2,4-9H3/t21-,22-,23+,26+,27+,28-,31+,32+,33+/m0/s1
SMILES C=C1[C@@H]([C@@]2(C)C=CC(=O)OC(C)(C)[C@@H]2CC(=O)OC)[C@@H](OC(C)=O)[C@H](OC(=O)C(C)C)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]132
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAmoora tsangii Ref.
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