(Q105011011)

English

(2E,4E,6E)-N-[5-hydroxy-5-[(1E,3E,5E)-7-[(2-hydroxy-5-oxocyclopenten-1-yl)amino]-7-oxohepta-1,3,5-trienyl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-9-methyldeca-2,4,6-trienamide

group of stereoisomers with the chemical formula C₂₉H₃₂N₂O₇

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

520.220951364 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₃₂N₂O₇

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canonical SMILES

CC(C)CC=CC=CC=CC(=O)NC1=CC(O)(C=CC=CC=CC(=O)NC2=C(O)CCC2=O)C2OC2C1=O

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isomeric SMILES

CC(C)C/C=C/C=C/C=C/C(=O)NC1=CC(O)(/C=C/C=C/C=C/C(=O)NC2=C(O)CCC2=O)C2OC2C1=O

1 reference

1 reference

EI-1511-3, -5 and EI-1625-2, novel interleukin-1 beta converting enzyme inhibitors produced by Streptomyces sp. E-1511 and E-1625. III. Biochemical properties of EI-1511-3, -5 and EI-1625-2

Identifiers

InChI

InChI=1S/C29H32N2O7/c1-19(2)12-8-4-3-5-9-13-23(34)30-20-18-29(37,28-27(38-28)26(20)36)17-11-7-6-10-14-24(35)31-25-21(32)15-16-22(25)33/h3-11,13-14,17-19,27-28,32,37H,12,15-16H2,1-2H3,(H,30,34)(H,31,35)/b5-3+,7-6+,8-4+,13-9+,14-10+,17-11+

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InChIKey

GLLPHENDWDLKRH-GXCWGJJBSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GLLPHENDWDLKRH-GXCWGJJBSA-N

1 reference

(Q105011011)

(2E,4E,6E)-N-[5-hydroxy-5-[(1E,3E,5E)-7-[(2-hydroxy-5-oxocyclopenten-1-yl)amino]-7-oxohepta-1,3,5-trienyl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-9-methyldeca-2,4,6-trienamide

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Identifiers

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