Pentanedioic acid, 2-oxo-, 5-[3-(2-amino-2-carboxyethyl)-1H-indol-5-yl] ester, compd. with 5-hydroxy-6-methyl-3,4-pyridinedimethanol (1:1)
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![Pentanedioic acid, 2-oxo-, 5-[3-(2-amino-2-carboxyethyl)-1H-indol-5-yl] ester, compd. with 5-hydroxy-6-methyl-3,4-pyridinedimethanol (1:1) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/3e3acc6c11584239b8e472eaa5668e66.png "Pentanedioic acid, 2-oxo-, 5-[3-(2-amino-2-carboxyethyl)-1H-indol-5-yl] ester, compd. with 5-hydroxy-6-methyl-3,4-pyridinedimethanol (1:1)")
Pentanedioic acid, 2-oxo-, 5-[3-(2-amino-2-carboxyethyl)-1H-indol-5-yl] ester, compd. with 5-hydroxy-6-methyl-3,4-pyridinedimethanol (1:1)
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CAS No:
34104-48-8
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Formula:
C16H16N2O7.C8H11NO3
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Chemical Name:
Pentanedioic acid, 2-oxo-, 5-[3-(2-amino-2-carboxyethyl)-1H-indol-5-yl] ester, compd. with 5-hydroxy-6-methyl-3,4-pyridinedimethanol (1:1)
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Synonyms:
Pentanedioic acid,2-oxo-,5-[3-(2-amino-2-carboxyethyl)-1H-indol-5-yl] ester,compd. with 5-hydroxy-6-methyl-3,4-pyridinedimethanol (1:1);Glutaric acid,2-oxo-,5-ester with 5-hydroxytryptophan,compd. with pyridoxol (1:1);Tryptophan,5-(4-carboxy-1,4-dioxobutoxy)-,compd. with 5-hydroxy-6-methyl-3,4-pyridinedimethanol (1:1);3,4-Pyridinedimethanol,5-hydroxy-6-methyl-,compd. with 5-(4-carboxy-1,4-dioxobutoxy)tryptophan (1:1)
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CAS No:
Pentanedioic acid, 2-oxo-, 5-[3-(2-amino-2-carboxyethyl)-1H-indol-5-yl] ester, compd. with 5-hydroxy-6-methyl-3,4-pyridinedimethanol (1:1) Basic Attributes
517.48500
517.16964407
251-829-1
DTXSID10187699
Computed Properties
Molecular Weight:517.5
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:11
Exact Mass:517.16964407
Monoisotopic Mass:517.16964407
Topological Polar Surface Area:233
Heavy Atom Count:37
Complexity:693
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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