input word = C00037173

Metabolite InformationStructural formula
Name Gemin D
Formula C27H22O18
Mw 634.0806139
CAS RN 84744-46-7
C_ID C00037173 ,
InChIKey XKVYZLLWKHGKMT-UHFFFAOYNA-N
InChICode InChI=1S/C27H22O18/c28-5-14(33)23(44-25(40)7-1-10(29)18(35)11(30)2-7)24-15(34)6-43-26(41)8-3-12(31)19(36)21(38)16(8)17-9(27(42)45-24)4-13(32)20(37)22(17)39/h1-5,14-15,23-24,29-39H,6H2/t14-,15-,23-,24-/m0/s1
SMILES O1C[C@@H]([C@H](OC(=O)c2cc(c(c(c2c2c(C1=O)cc(c(c2O)O)O)O)O)O)[C@@H](OC(=O)c1cc(c(c(c1)O)O)O)[C@@H](O)C=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCornaceaeCamptotheca acuminata Ref.
PlantaeCornaceae/Aucubaceae/Garryaceae/HelwingiaceaeCornus officinalis Ref.
PlantaeLythraceaePunica granatum Ref.
PlantaeOnagraceaeOenothera tetraptera Ref.
PlantaeTamaricaceaeTamarix nilotica Ref.
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