input word = C00058982

Metabolite InformationStructural formula
Name Glycinoeclepin C
Formula C29H38O8
Mw 514.25666819
CAS RN 103847-20-7
C_ID C00058982
InChIKey QEICCHKVLICFMW-ZTXCTZRESA-N
InChICode InChI=1S/C29H38O8/c1-14(23(31)32)9-17-10-15(2)27(5)21(36-17)12-18-22(24(33)34)16(11-19(30)28(18,27)6)13-29-8-7-20(37-29)26(3,4)25(29)35/h9,12,15,17,19-21,30H,7-8,10-11,13H2,1-6H3,(H,31,32)(H,33,34)/b14-9+/t15-,17+,19-,20+,21-,27-,28+,29+/m1/s1
SMILES CC(=CC1CC(C)C2(C)C(C=C3C(C(=O)O)=C(CC45CCC(O4)C(C)(C)C5=O)CC(O)C32C)O1)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePhaseolus vulgaris Ref.
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