(Q59191782)

English

(2R,3E)-5-Chloro-N-[(2E,4R)-2,4-dimethyl-5-oxo-5-(1-pyrrolidinyl)-2-penten-1-yl]-2,4-dimethyl-N-(phenylmethyl)-3-pentenamide

polyketide

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Statements

group of stereoisomers

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chemical compound

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430.23870604 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₅H₃₅ClN₂O₂

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC(=CC(C)C(=O)N(CC(C)=CC(C)C(=O)N1CCCC1)Cc1ccccc1)CCl

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

C/C(=C\C(C)C(=O)N(C/C(C)=C/[C@H](C)C(=O)N1CCCC1)Cc2ccccc2)CCl

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Identifiers

InChI=1S/C25H35ClN2O2/c1-19(16-26)14-21(3)25(30)28(18-23-10-6-5-7-11-23)17-20(2)15-22(4)24(29)27-12-8-9-13-27/h5-7,10-11,14-15,21-22H,8-9,12-13,16-18H2,1-4H3/b19-14+,20-15+/t21?,22-/m0/s1

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HGAFTKMUBLJXES-FNUWSGBJSA-N

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CAS Registry Number

reason for deprecated rank

cannot be confirmed by other sources

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UniChem compound ID

1 reference

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