input word = C00006416

Metabolite InformationStructural formula
Name Hoslunddiol
Formula C22H22O7
Mw 398.13655306
CAS RN 135404-53-4
C_ID C00006416 ,
InChIKey URTJMLCOGKHVDK-CGTUWMBANA-N
InChICode InChI=1S/C22H22O7/c1-11-21(25)14(24)9-17(28-11)20-16(27-2)10-18-19(22(20)26)13(23)8-15(29-18)12-6-4-3-5-7-12/h3-8,10-11,14,17,21,24-26H,9H2,1-2H3/t11-,14-,17+,21+/m1/s1
SMILES COc1cc2oc(-c3ccccc3)cc(=O)c2c(O)c1[C@H]1C[C@@H](O)[C@H](O)C(C)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeHoslundia opposita Ref.
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