input word = C00039467

Metabolite InformationStructural formula
Name Itoside H
(-)-Itoside H
Formula C27H26O11
Mw 526.14751167
CAS RN 1000070-04-1
C_ID C00039467 ,
InChIKey VFIRGCIMGONIHP-SRYNIGNHNA-N
InChICode InChI=1S/C27H26O11/c28-17-10-11-20(16(12-17)13-35-26(34)18-8-4-5-9-19(18)29)37-27-24(32)23(31)22(30)21(38-27)14-36-25(33)15-6-2-1-3-7-15/h1-12,21-24,27-32H,13-14H2/t21-,22-,23+,24-,27-/m1/s1
SMILES [C@@H]1([C@@H]([C@H]([C@@H](O[C@@H]1COC(=O)c1ccccc1)Oc1c(cc(cc1)O)COC(=O)c1ccccc1O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFlacourtiaceaeItoa orientalis Ref.
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