input word = C00031718

Metabolite InformationStructural formula
Name Cypellogin C
(+)-Cypellogin C
Formula C31H36O14
Mw 632.21050586
CAS RN 872419-00-6
C_ID C00031718 ,
InChIKey JZWMWNFZJXHMLJ-CDMIMTESNA-N
InChICode InChI=1S/C31H36O14/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/h5,8-11,13,15,21,23,25-26,30,32-36,38-39,41H,3-4,6-7,12H2,1-2H3/t13-,15+,21-,23+,25+,26-,30+/m1/s1
SMILES CC(C)(O)C1CCC(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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OrganismEucalyptus cypellocarpa
ReferenceKasajima,Chem.Pharm.Bull.,53,(2005),1345