input word = C00049841

Metabolite InformationStructural formula
Name Stecholide M
Formula C30H40O13
Mw 608.24689137
CAS RN 152340-00-6
C_ID C00049841 ,
InChIKey XEMNZAFIRFCEFP-SEYXRHQNNA-N
InChICode InChI=1S/C30H40O13/c1-9-10-19(34)40-17-11-13(2)12-18-30(29(8,43-30)26(36)41-18)25(39-16(5)33)21-27(6,22(17)37-14(3)31)23(38-15(4)32)20(35)24-28(21,7)42-24/h12,17-18,20-25,35H,9-11H2,1-8H3/b13-12-/t17-,18-,20-,21+,22+,23-,24-,25-,27-,28+,29-,30-/m0/s1
SMILES CCCC(=O)OC1C/C(C)=CC2OC(=O)C3(C)OC23C(OC(C)=O)C2C3(C)OC3C(O)C(OC(C)=O)C2(C)C1OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Briareum sp. Ref.
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