pentapotassium;2-[bis[2-[bis(carboxylatomethyl)amino]ethyl]amino]acetate

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pentapotassium;2-[bis[2-[bis(carboxylatomethyl)amino]ethyl]amino]acetate

UUID aba25c0c-1433-4509-89bd-a8f58cf88d59

Deprecated yes

Replaced By 26160a42-5136-42e6-9e6a-3c715e8120f3

Flow Object ID fo-feed501c8eb5c8cf

Source EF 3.1

Context Environmental → Water → Unknown

CAS Numbers 7216-95-7

EC Numbers 404-290-3

prefLabel ⓘ

Language	Value	Provenance
`en`	`pentapotassium;2-[bis[2-[bis(carboxylatomethyl)amino]ethyl]amino]acetate`

altLabel ⓘ

Language	Value	Provenance
`en`	`Glycine, <em>N</em>,<em>N</em>-bis[2-[bis(carboxymethyl)amino]ethyl]-, pentapotassium salt`
`en`	`Glycine, <em>N</em>,<em>N</em>-bis[2-[bis(carboxymethyl)amino]ethyl]-, potassium salt (1:5)`
`en`	`K<sub>5</sub>DTPA`
`en`	`Pentapotassium diethylenetriaminepentaacetate`

References

Shared Properties

Predicate	Value
InChIKey	`ALAWNHZZNUDBAO-UHFFFAOYSA-I, AVTREVLJQWPYFS-UHFFFAOYSA-N, LRNLJCBZAUJMIS-UHFFFAOYSA-I, MVQWXPPVCDOHQI-UHFFFAOYSA-N`
InChI	InChI=1S/C14H23N3O10.25K/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27;;;;;;;;;;;;;;;;;;;;;;;;;/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27);;;;;;;;;;;;;;;;;;;;;;;;;/q;25+1/p-5, InChI=1S/C14H23N3O10.5K/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27;;;;;/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27);;;;;, InChI=1S/C14H23N3O10.5K/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27;;;;;/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27);;;;;/q;5+1/p-5, InChI=1S/C14H23N3O10.K/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27;/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27);
IUPAC name	`pentacosapotassium;2-[bis[2-[bis(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethyl]amino]ethanoate, pentacosapotassium;2-[bis[2-[bis(carboxylatomethyl)amino]ethyl]amino]acetate, pentapotassium;2-[bis[2-[bis(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethyl]amino]ethanoate, pentapotassium;2-[bis[2-[bis(carboxylatomethyl)amino]ethyl]amino]acetate`
Molecular formula	`C14H18K25N3O10+20, C14H18K5N3O10, C14H23K5N3O10, C14H23KN3O10`
SMILES	`C(CN(CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O.[K], C(CN(CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O.[K].[K].[K].[K].[K], C(CN(CC(=O)[O-])CC(=O)[O-])N(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[K+].[K+].[K+].[K+].[K+], C(CN(CC(=O)[O-])CC(=O)[O-])N(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+]`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`aba25c0c-1433-4509-89bd-a8f58cf88d59`	pentapotassium 2-[2-[2-(bis(carboxylatomethyl)amino)ethyl-(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field	Change Count	Latest Time	Transformers	Latest Comment
`altLabel`	2	`—`	consensus_match	group_key=pentapotassium2-[2-[2-(bis(carboxylatomethyl)amino)ethyl-(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=7216-95-7; added Common Chemistry CAS names as altLabel: Glycine, <em>N</em>,<em>N</em>-bis[2-[bis(carboxymethyl)amino]ethyl]-, pentapotassium salt, Glycine, <em>N</em>,<em>N</em>-bis[2-[bis(carboxymethyl)amino]ethyl]-, potassium salt (1:5), K<sub>5</sub>DTPA, Pentapotassium diethylenetriaminepentaacetate; object_uuid=fo-feed501c8eb5c8cf
`cas_match_labels`	1	`—`	consensus_match	group_key=pentapotassium2-[2-[2-(bis(carboxylatomethyl)amino)ethyl-(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=[]; cas_sources={'7216-95-7': []}; assigned CAS labels from group consensus; object_uuid=fo-feed501c8eb5c8cf: {'7216-95-7': 'exactMatch'}
`prefLabel`	1	`—`	consensus_match	group_key=pentapotassium2-[2-[2-(bis(carboxylatomethyl)amino)ethyl-(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=7216-95-7; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=3.9269; pubchem_entropy=3.9389; current_score=4.9569; pubchem_score=4.5489; score_improvement=0.4080; threshold=0.400; min_margin=0.400; object_uuid=fo-feed501c8eb5c8cf

Context Attributes

Attribute	Value
dimension	Environmental
media	Water
water_body	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`prefLabel`	`[{'@value': 'Pentapotassium 2-[2-[2-(bis(carboxylatomethyl)amino)ethyl-(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}]`	`[{'@value': 'pentapotassium;2-[bis[2-[bis(carboxylatomethyl)amino]ethyl]amino]acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:7216-95-7', 'name:pentapotassium;2-[bis[2-[bis(carboxylatomethyl)amino]ethyl]amino]acetate', 'https://pubchem.ncbi.nlm.nih.gov/compound/10167209'], 'prov:wasDerivedFrom': 'pubchem preferred label selection'}}]`	group_key=pentapotassium2-[2-[2-(bis(carboxylatomethyl)amino)ethyl-(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=7216-95-7; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=3.9269; pubchem_entropy=3.9389; current_score=4.9569; pubchem_score=4.5489; score_improvement=0.4080; threshold=0.400; min_margin=0.400; object_uuid=fo-feed501c8eb5c8cf
`altLabel`	`None`	`[{'@value': 'Pentapotassium 2-[2-[2-(bis(carboxylatomethyl)amino)ethyl-(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original EF name retained as altLabel'}}]`	group_key=pentapotassium2-[2-[2-(bis(carboxylatomethyl)amino)ethyl-(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=7216-95-7; added current EF name as altLabel when prefLabel differs; object_uuid=fo-feed501c8eb5c8cf
`altLabel`	`[{'@value': 'Pentapotassium 2-[2-[2-(bis(carboxylatomethyl)amino)ethyl-(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original EF name retained as altLabel'}}]`	[{'@value': 'Glycine, <em>N</em>,<em>N</em>-bis[2-[bis(carboxymethyl)amino]ethyl]-, pentapotassium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:7216-95-7', 'https://commonchemistry.cas.org/detail?cas_rn=7216-95-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Glycine, <em>N</em>,<em>N</em>-bis[2-[bis(carboxymethyl)amino]ethyl]-, potassium salt (1:5)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:7216-95-7', 'https://commonchemistry.cas.org/detail?cas_rn=7216-95-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'K<sub>5</sub>DTPA', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:7216-95-7', 'https://commonchemistry.cas.org/detail?cas_rn=7216-95-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pentapotassium diethylenetriaminepentaacetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:7216-95-7', 'https://commonchemistry.cas.org/detail?cas_rn=7216-95-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=pentapotassium2-[2-[2-(bis(carboxylatomethyl)amino)ethyl-(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=7216-95-7; added Common Chemistry CAS names as altLabel: Glycine, <em>N</em>,<em>N</em>-bis[2-[bis(carboxymethyl)amino]ethyl]-, pentapotassium salt, Glycine, <em>N</em>,<em>N</em>-bis[2-[bis(carboxymethyl)amino]ethyl]-, potassium salt (1:5), K<sub>5</sub>DTPA, Pentapotassium diethylenetriaminepentaacetate; object_uuid=fo-feed501c8eb5c8cf
`cas_match_labels`	`None`	`{'7216-95-7': 'exactMatch'}`	group_key=pentapotassium2-[2-[2-(bis(carboxylatomethyl)amino)ethyl-(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=[]; cas_sources={'7216-95-7': []}; assigned CAS labels from group consensus; object_uuid=fo-feed501c8eb5c8cf: {'7216-95-7': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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    "water_body": "Unknown"
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  "unit": "kg",
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      "source_metadata": {
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