input word = C00044957

Metabolite InformationStructural formula
Name Nigrolineaquinone A
Formula C27H38O3
Mw 410.28209508
CAS RN 643026-21-5
C_ID C00044957 ,
InChIKey UIUVNWSNDJMLEF-VOLDSXALSA-N
InChICode InChI=1S/C27H38O3/c1-19(2)10-7-11-20(3)12-8-13-21(4)14-9-15-22(5)16-17-24-26(29)23(6)18-25(28)27(24)30/h10,12,14,16,18,30H,7-9,11,13,15,17H2,1-6H3/b20-12+,21-14+,22-16+
SMILES C1(=O)C=C(C(=O)C(=C1O)C/C=C(/CC/C=C(/CC/C=C(/CCC=C(C)C)\C)\C)\C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia nigrolineata Ref.
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