input word = C00039891

Metabolite InformationStructural formula
Name Nymphaeol C
Formula C30H36O6
Mw 492.25118888
CAS RN 73676-36-5
C_ID C00039891 ,
InChIKey SZHDIKOQLFZADP-PMCIHSQNNA-N
InChICode InChI=1S/C30H36O6/c1-17(2)7-6-8-19(5)10-12-21-20(13-14-23(31)29(21)34)26-16-25(33)28-27(36-26)15-24(32)22(30(28)35)11-9-18(3)4/h7,9-10,13-15,26,31-32,34-35H,6,8,11-12,16H2,1-5H3/b19-10+/t26-/m0/s1
SMILES c1(c(c(c2c(c1)O[C@@H](CC2=O)c1c(c(c(cc1)O)O)C/C=C(\C)/CCC=C(C)C)O)CC=C(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeMacaranga tanarius Ref.
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OrganismMacaranga tanarius
ReferenceKawakami,J.Nat.Prod.,71,(2008),1872