input word = C00044967

Metabolite InformationStructural formula
Name Nigrolineaxanthone S
Formula C28H30O5
Mw 446.20932407
CAS RN 643026-20-4
C_ID C00044967 ,
InChIKey RBHZFZSVMMGEQW-VCHYOVAHNA-N
InChICode InChI=1S/C28H30O5/c1-17(2)8-5-9-18(3)10-7-14-28(4)15-13-19-23(33-28)16-22(30)24-25(31)20-11-6-12-21(29)26(20)32-27(19)24/h6,8,10-13,15-16,29-30H,5,7,9,14H2,1-4H3/b18-10+/t28-/m0/s1
SMILES c1ccc2c(c1O)oc1c(c2=O)c(cc2c1C=C[C@](O2)(C)CC/C=C(\C)/CCC=C(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia nigrolineata Ref.
zoom in