input word = C00056840

Metabolite InformationStructural formula
Name Rhodomyrtosone A
Formula C26H32O7
Mw 456.21480338
CAS RN 1079988-16-1
C_ID C00056840
InChIKey BTVCDTWMBDQZMY-BCHFMIIMSA-N
InChICode InChI=1S/C26H32O7/c1-11(2)9-13(27)16-14(28)10-15(29)17-19-18-21(30)24(5,6)23(31)25(7,8)22(18)33-26(19,12(3)4)32-20(16)17/h10-12,19,28-29H,9H2,1-8H3/t19-,26+/m1/s1
SMILES CC(C)CC(=O)c1c(O)cc(O)c2c1O[C@@]1(C(C)C)OC3=C(C(=O)C(C)(C)C(=O)C3(C)C)[C@@H]21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMyrtaceaeRhodomyrtus tomentosa Ref.
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