(Q104246296)

English

(3aS,7aS)-N-(5-carbamimidamido-1-oxopentan-2-yl)-6-hydroxy-1-[(2S)-2-[(1-hydroxyoctylidene)amino]-3-(4-hydroxyphenyl)propanoyl]-octahydroindole-2-carboximidic acid

group of stereoisomers with the chemical formula C₃₂H₅₀N₆O₆

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Statements

group of stereoisomers

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chemical compound

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614.3791833200002 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₃₂H₅₀N₆O₆

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canonical SMILES

CCCCCCCC(=O)NC(Cc1ccc(O)cc1)C(=O)N1C(C(=O)NC(C=O)CCCNC(=N)N)CC2CCC(O)CC21

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isomeric SMILES

CCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1C(C(=O)NC(C=O)CCCNC(=N)N)C[C@@H]2CCC(O)C[C@@H]21

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Identifiers

InChI=1S/C32H50N6O6/c1-2-3-4-5-6-9-29(42)37-26(17-21-10-13-24(40)14-11-21)31(44)38-27-19-25(41)15-12-22(27)18-28(38)30(43)36-23(20-39)8-7-16-35-32(33)34/h10-11,13-14,20,22-23,25-28,40-41H,2-9,12,15-19H2,1H3,(H,36,43)(H,37,42)(H4,33,34,35)/t22-,23?,25?,26-,27-,28?/m0/s1

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VXNDIAFIQMKCRY-JHNXQRGNSA-N

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