input word = C00003441

Metabolite InformationStructural formula
Name Inumakilactone A glycoside
Formula C24H30O13
Mw 526.16864105
CAS RN 37850-48-9
C_ID C00003441 ,
InChIKey QGWDZDZECYBAPW-KMRMMKIINA-N
InChICode InChI=1S/C24H30O13/c1-6(32-20-12(29)11(28)10(27)7(5-25)33-20)17-24-8(4-9(26)34-17)22(2)15-13(19(24)37-24)36-21(31)23(15,3)16(30)14-18(22)35-14/h4,6-7,10-20,25,27-30H,5H2,1-3H3/t6-,7+,10+,11-,12+,13-,14+,15+,16-,17+,18+,19+,20-,22+,23+,24?/m0/s1
SMILES [C@@H]12[C@@H]([C@]3([C@H]4[C@]([C@@H]1O2)(C1=CC(=O)O[C@@H]([C@@]21[C@@H]([C@H]4OC3=O)O2)[C@H](C)O[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePodocarpaceaePodocarpus macrophyllus Ref.
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