input word = C00014111

Metabolite InformationStructural formula
Name Aloe resin D
Formula C29H32O11
Mw 556.19446187
CAS RN 105317-67-7
C_ID C00014111 ,
InChIKey OUGNWRCWQLUXHX-KEWYNEHMNA-N
InChICode InChI=1S/C29H32O11/c1-14-10-20(37-3)24(27-23(14)19(33)12-18(38-27)11-15(2)31)28-29(26(36)25(35)21(13-30)39-28)40-22(34)9-6-16-4-7-17(32)8-5-16/h4-10,12,15,21,25-26,28-32,35-36H,11,13H2,1-3H3/b9-6+/t15-,21-,25-,26+,28+,29-/m1/s1
SMILES COc1cc(C)c2c(=O)cc(C[C@@H](C)O)oc2c1[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1OC(=O)/C=C/c1ccc(O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsphodelaceaeAloe ferox Ref.
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