input word = C00033247

Metabolite InformationStructural formula
Name Neonuezhenide
Formula C31H42O18
Mw 702.23711454
CAS RN 96382-91-1
C_ID C00033247 ,
InChIKey IQOYABZSYGZAAQ-LJDBHPMHNA-N
InChICode InChI=1S/C31H42O18/c1-3-14-15(16(28(42)43-2)11-46-29(14)49-31-27(41)24(38)22(36)19(10-32)47-31)9-21(35)45-12-20-23(37)25(39)26(40)30(48-20)44-7-6-13-4-5-17(33)18(34)8-13/h3-5,8,11,15,19-20,22-27,29-34,36-41H,6-7,9-10,12H2,1-2H3/b14-3+/t15-,19+,20+,22+,23+,24-,25-,26+,27+,29-,30+,31-/m0/s1
SMILES O1C=C([C@H](/C(=C\C)/[C@@H]1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)CC(=O)OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)OCCc1cc(c(cc1)O)O)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeLigustrum lucidum Ref.
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