input word = C00030015

Metabolite InformationStructural formula
Name Corymbocoumarin
Formula C21H24O7
Mw 388.15220312
CAS RN 675130-68-4
C_ID C00030015 ,
InChIKey CVCGZZMJIGSWHX-CADQVKBRNA-N
InChICode InChI=1S/C21H24O7/c1-6-11(2)20(24)27-18-16-14(28-21(4,5)19(18)25-12(3)22)9-7-13-8-10-15(23)26-17(13)16/h7-11,18-19H,6H2,1-5H3/t11-,18-,19-/m0/s1
SMILES c12c(ccc3c1[C@@H]([C@@H](C(O3)(C)C)OC(=O)C)OC(=O)[C@@H](C)CC)ccc(=O)o2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeSeseli gummiferum subsp.corymbosum Ref.
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