input word = C00031716

Metabolite InformationStructural formula
Name Cypellogin A
(-)-Cypellogin A
Formula C31H34O14
Mw 630.1948558
CAS RN 872418-98-9
C_ID C00031716 ,
InChIKey GUDLVBZWVXAHOX-FCAGCZTRNA-N
InChICode InChI=1S/C31H34O14/c1-31(2,41)15-6-3-13(4-7-15)29(40)42-12-21-23(36)25(38)26(39)30(44-21)45-28-24(37)22-19(35)10-16(32)11-20(22)43-27(28)14-5-8-17(33)18(34)9-14/h3,5,8-11,15,21,23,25-26,30,32-36,38-39,41H,4,6-7,12H2,1-2H3/t15-,21+,23+,25-,26+,30-/m0/s1
SMILES CC(C)(O)[C@H]1CC=C(C(=O)OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)CC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMyrtaceaeEucalyptus cypellocarpa Ref.
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