input word = C00038819

Metabolite InformationStructural formula
Name Coelovirin A
(-)-Coelovirin A
Formula C21H30O12
Mw 474.17372642
CAS RN 452963-01-8
C_ID C00038819 ,
InChIKey HXJSMUHQCRYXNT-PBWPJYOLNA-N
InChICode InChI=1S/C21H30O12/c1-3-10(2)21(30,17(26)18(27)28)20(29)31-9-11-4-6-12(7-5-11)32-19-16(25)15(24)14(23)13(8-22)33-19/h4-7,10,13-17,19,22-26,30H,3,8-9H2,1-2H3,(H,27,28)/t10-,13-,14-,15+,16-,17-,19-,21-/m1/s1
SMILES c1c(ccc(c1)COC(=O)[C@]([C@@H](C(=O)O)O)([C@H](C)CC)O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrchidaceaeGymnadenia conopsea Ref.
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