input word = C00051542

Metabolite InformationStructural formula
Name Mesuaferrol
Formula C35H46O6
Mw 562.3294392
CAS RN 116446-48-1
C_ID C00051542
InChIKey IOHVIMQDDPQYKZ-UHFFFAOYNA-N
InChICode InChI=1S/C35H46O6/c1-20(2)15-16-26(22(5)6)19-34(18-17-21(3)4)32(39)29(35(40,25(9)36)27-13-11-10-12-14-27)31(38)28-30(37)23(7)24(8)41-33(28)34/h10-15,17,23-24,28,33,38,40H,16,18-19H2,1-9H3
SMILES CC(=O)C(O)(C1=C(O)C2C(=O)C(C)C(C)OC2C(CC=C(C)C)(CC(CC=C(C)C)=C(C)C)C1=O)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae-GuttiferaeMesua ferrea Ref.
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