input word = C00030408

Metabolite InformationStructural formula
Name Globularioside
Formula C24H29ClO11
Mw 528.13983948
CAS RN 886061-45-6
C_ID C00030408 ,
InChIKey XCKBJQOQFOWFPZ-LTMSLREYNA-N
InChICode InChI=1S/C24H29ClO11/c25-21-17(28)13-8-9-33-22(36-23-20(31)19(30)18(29)14(10-26)35-23)16(13)24(21,32)11-34-15(27)7-6-12-4-2-1-3-5-12/h1-9,13-14,16-23,26,28-32H,10-11H2/b7-6+/t13-,14+,16+,17-,18+,19-,20+,21-,22-,23-,24-/m0/s1
SMILES O1C=C[C@H]2[C@H]([C@@H]1O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)[C@]([C@H]([C@H]2O)Cl)(COC(=O)/C=C/c1ccccc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGlobulariaceaeGlobularia alypum Ref.
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