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 c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)COC(=O)[C@H]1CC[C@H](CC1)C(C)(O)C)O)O)O)c1ccc(c(c1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMyrtaceaeEucalyptus cypellocarpa Ref.
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