input word = C00052080

Metabolite InformationStructural formula
Name Glycobismine B
Formula C37H34N2O7
Mw 618.23660146
CAS RN 148717-57-1
C_ID C00052080
InChIKey VORJSZDMACDOQD-UHFFFAOYSA-N
InChICode InChI=1S/C37H34N2O7/c1-18(2)14-15-37(45)34-29(32(42)20-11-7-9-13-23(20)39(34)5)33(43)27(35(37)44)21-17-36(3,4)46-25-16-24(40)28-30(26(21)25)38-22-12-8-6-10-19(22)31(28)41/h6-14,16,21,40,43,45H,15,17H2,1-5H3,(H,38,41)
SMILES O=C1C2=C(C(C/C=C(C)/C)(O)C(C(C3([H])CC(C)(C)OC4=CC(O)=C5C(C6=C(NC5=C43)C=CC=C6)=O)=C2O)=O)N(C)C7=C1C=CC=C7
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeGlycosmis citrifolia Ref.
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