input word = C00010801

Metabolite InformationStructural formula
Name Xylomollin
Formula C12H18O7
Mw 274.10525293
CAS RN 61229-34-3
C_ID C00010801 ,
InChIKey IYOMTPNHJRSLSB-UHFFFAOYNA-N
InChICode InChI=1S/C12H18O7/c1-5-8-6(4-7(13)18-5)9(10(14)16-2)12(17-3)19-11(8)15/h5-6,8-9,11-12,15H,4H2,1-3H3/t5-,6-,8+,9-,11+,12+/m0/s1
SMILES [C@H]12[C@H]([C@@H](O[C@H]([C@@H]1C(=O)OC)OC)O)[C@@H](OC(=O)C2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeXylocarpus moluccensis Ref.
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OrganismXylocarpus moluccensis
ReferenceKubo,J.Am.Chem.Soc.,98,(1976),6704