(Q103817899)

English

4-[[4-[[4-[[3-Carboxy-3-methoxy-2-[[4-[(4-nitrobenzoyl)amino]benzoyl]amino]propanoyl]amino]benzoyl]amino]-2-hydroxy-3-propan-2-yloxybenzoyl]amino]-3-propan-2-yloxybenzoic acid

group of stereoisomers with the chemical formula C₄₆H₄₄N₆O₁₅

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instance of

group of stereoisomers

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subclass of

p-nitrophenyl polyketide

1 reference

inferred from

p-nitrophenyl polyketide

mass

920.2864647080003 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₆H₄₄N₆O₁₅

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canonical SMILES

COC(C(=O)O)C(NC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1)C(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)Nc3ccc(C(=O)O)cc3OC(C)C)c(O)c2OC(C)C)cc1

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Identifiers

InChI

InChI=1S/C46H44N6O15/c1-23(2)66-35-22-28(45(59)60)12-20-33(35)49-43(57)32-19-21-34(38(37(32)53)67-24(3)4)50-41(55)25-6-15-30(16-7-25)48-44(58)36(39(65-5)46(61)62)51-42(56)26-8-13-29(14-9-26)47-40(54)27-10-17-31(18-11-27)52(63)64/h6-24,36,39,53H,1-5H3,(H,47,54)(H,48,58)(H,49,57)(H,50,55)(H,51,56)(H,59,60)(H,61,62)

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InChIKey

COERGQLNLZNYLZ-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

COERGQLNLZNYLZ-UHFFFAOYSA-N

1 reference

(Q103817899)

4-[[4-[[4-[[3-Carboxy-3-methoxy-2-[[4-[(4-nitrobenzoyl)amino]benzoyl]amino]propanoyl]amino]benzoyl]amino]-2-hydroxy-3-propan-2-yloxybenzoyl]amino]-3-propan-2-yloxybenzoic acid

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Identifiers

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