input word = C00039814

Metabolite InformationStructural formula
Name Myrtucommulone F
(+)-Myrtucommulone F
Formula C40H56O10
Mw 696.38734801
CAS RN 1051388-73-8
C_ID C00039814 ,
InChIKey LQEXHUUSBGSPPT-XHEJRLEYNA-N
InChICode InChI=1S/C40H56O10/c1-14-15-16-17-20(41)23-28(42)24(21(18(2)3)26-31(45)37(6,7)35(49)38(8,9)32(26)46)30(44)25(29(23)43)22(19(4)5)27-33(47)39(10,11)36(50)40(12,13)34(27)48/h18-19,21-22,42-45,47H,14-17H2,1-13H3/t21-,22-/m1/s1
SMILES c1(c(c(c(c(c1O)[C@H](C1=C(C(C(=O)C(C1=O)(C)C)(C)C)O)C(C)C)O)C(=O)CCCCC)O)[C@H](C1=C(C(C(=O)C(C1=O)(C)C)(C)C)O)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMyrtaceaeCorymbia scabrida Ref.
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OrganismCorymbia scabrida
ReferenceCarroll,J.Nat.Prod.,71,(2008),1564