input word = C00043732

Metabolite InformationStructural formula
Name Minabein 4
Formula C26H33ClO10
Mw 540.17622499
CAS RN 104993-10-4
C_ID C00043732 ,
InChIKey AGDFENFYSVKDGA-CMDGGOBGNA-N
InChICode InChI=1S/C26H33ClO10/c1-12-8-9-17(34-14(3)28)24(6)11-10-18(35-15(4)29)25(7,32)20(24)22(36-16(5)30)26(33)13(2)23(31)37-21(26)19(12)27/h8-11,13,17-22,32-33H,1H2,2-7H3/b9-8+/t13-,17+,18-,19-,20-,21+,22+,24-,25+,26+/m1/s1
SMILES C=C1/C=C/C(OC(C)=O)C2(C)C=CC(OC(C)=O)C(C)(O)C2C(OC(C)=O)C2(O)C(C)C(=O)OC2C1Cl
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Eleutherobia sp. Ref.
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