input word = C00039816

Metabolite InformationStructural formula
Name Myrtucommulone H
(+)-Myrtucommulone H
Formula C41H58O10
Mw 710.40299807
CAS RN 1051388-75-0
C_ID C00039816 ,
InChIKey BHCDLVJZEUNTHT-HLOJJTHLNA-N
InChICode InChI=1S/C41H58O10/c1-14-15-16-17-22(42)26-29(43)24(21(18-19(2)3)25-32(46)38(6,7)36(50)39(8,9)33(25)47)30(44)27(31(26)45)23(20(4)5)28-34(48)40(10,11)37(51)41(12,13)35(28)49/h19-21,23,43-46,48H,14-18H2,1-13H3/t21-,23-/m1/s1
SMILES c1(c(c(c(c(c1O)[C@H](C1=C(C(C(=O)C(C1=O)(C)C)(C)C)O)CC(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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