input word = C00060869

Metabolite InformationStructural formula
Name 14-Hydroxy-14,15-dihydrogranatumin C
Formula C32H40O10
Mw 584.2621475
CAS RN 2237974-38-6
C_ID C00060869
InChIKey IJQCZTPOXGMCHI-DJAOJNOASA-N
InChICode InChI=1S/C32H40O10/c1-8-16(2)27(36)41-25-22-23(35)30(6,19(28(25,3)4)13-20(33)38-7)18-9-11-29(5)24(17-10-12-39-15-17)40-21(34)14-31(29,37)32(18)26(22)42-32/h8,10,12,15,18-19,22,24-26,37H,9,11,13-14H2,1-7H3/b16-8+/t18-,19+,22-,24+,25-,26-,29+,30-,31?,32+/m1/s1
SMILES CC=C(C)C(=O)OC1C2C(=O)C(C)(C(CC(=O)OC)C1(C)C)C1CCC3(C)C(c4ccoc4)OC(=O)CC3(O)C13OC23
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeXylocarpus granatum Ref.
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