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Iprovalicarb

UUID 28bd7625-e6ff-4d0c-8613-dbace00362f9
Flow Object IDfo-0d03f690bf4c4c01
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 140923-17-7
EC Numbers 604-209-3
prefLabel
Language Value Provenance
en Iprovalicarb
altLabel ⓘ
Language Value Provenance
en 1-methylethyl N-[(1S)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]carbamate
en isopropyl [(1S)-2-methyl-1-{[(1RS)-1-p-tolylethyl]carbamoyl}propyl]carbamate
en 1-Methylethyl <em>N</em>-[(1<em>S</em>)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]carbamate
en Carbamic acid, <em>N</em>-[(1<em>S</em>)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]-, 1-methylethyl ester
en Carbamic acid, [(1<em>S</em>)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]-, 1-methylethyl ester
en Fencaramid
en SZX 0722
en Iprovalicarb (iso); Isopropyl [(2s)-3-methyl-1-{[1-(4-methylphenyl)ethyl]amino}-1-oxobutan-2-yl]carbamate
Definitions
Language Value Provenance
en A diastereoisomeric mixture comprising equimolar amounts of L-(R)- and L-(S)-iprovalicarb. It is a systemic fungicide, specific to oomycetes, used on potatoes and grape vines.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey NWUWYYSKZYIQAE-WMCAAGNKSA-N
InChI InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14?,16-/m0/s1
IUPAC name N-[(1S)-2-methyl-1-[1-(p-tolyl)ethylcarbamoyl]propyl]carbamic acid isopropyl ester, N-[(2S)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamic acid propan-2-yl ester, isopropyl N-[(1S)-2-methyl-1-[1-(p-tolyl)ethylcarbamoyl]propyl]carbamate, propan-2-yl N-[(2S)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxidanylidene-butan-2-yl]carbamate, propan-2-yl N-[(2S)-3-methyl-1-[1-(4-methylphenyl)ethylamino]-1-oxobutan-2-yl]carbamate
Molecular formula C18H28N2O3
Molecular mass 320.433
Monoisotopic mass 320.20999
SMILES CC1=CC=C(C=C1)C(C)NC(=O)C(C(C)C)NC(=O)OC(C)C, CC1=CC=C(C=C1)C(C)NC(=O)[C@H](C(C)C)NC(=O)OC(C)C, Cc1ccc(C(C)NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)cc1

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 28bd7625-e6ff-4d0c-8613-dbace00362f9 iprovalicarb (iso); isopropyl [(2s)-3-methyl-1-{[1-(4-methylphenyl)ethyl]amino}-1-oxobutan-2-yl]carbamate

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 iprovalicarb (iso); isopropyl [(2s)-3-methyl-1-{[1-(4-methylphenyl)ethyl]amino}-1-oxobutan-2-yl]carbamate Emissions/Emissions to water/Emissions to water, unspecified kg exactMatch —

Consolidated Field Provenance

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

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 — consensus_match group_key=iprovalicarb(iso);isopropyl[(2s)-3-methyl-1-{[1-(4-methylphenyl)ethyl]amino}-1-oxobutan-2-yl]carbamate||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=140923-17-7; added Common Chemistry CAS names as altLabel: 1-Methylethyl <em>N</em>-[(1<em>S</em>)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]carbamate, Carbamic acid, <em>N</em>-[(1<em>S</em>)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]-, 1-methylethyl ester, Carbamic acid, [(1<em>S</em>)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]-, 1-methylethyl ester, Fencaramid, Iprovalicarb, SZX 0722; object_uuid=fo-0d03f690bf4c4c01
cas_match_labels 1 — consensus_match group_key=iprovalicarb(iso);isopropyl[(2s)-3-methyl-1-{[1-(4-methylphenyl)ethyl]amino}-1-oxobutan-2-yl]carbamate||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi']; cas_sources={'140923-17-7': ['chebi']}; assigned CAS labels from group consensus; object_uuid=fo-0d03f690bf4c4c01: {'140923-17-7': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '1-methylethyl N-[(1S)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]carbamate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-methylethyl N-[(1S)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]carbamate', 'http://purl.obolibrary.org/obo/CHEBI_82023', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'isopropyl [(1S)-2-methyl-1-{[(1RS)-1-p-tolylethyl]carbamoyl}propyl]carbamate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:isopropyl [(1S)-2-methyl-1-{[(1RS)-1-p-tolylethyl]carbamoyl}propyl]carbamate', 'http://purl.obolibrary.org/obo/CHEBI_82023', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '1-methylethyl N-[(1S)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]carbamate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-methylethyl N-[(1S)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]carbamate', 'http://purl.obolibrary.org/obo/CHEBI_82023', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'isopropyl [(1S)-2-methyl-1-{[(1RS)-1-p-tolylethyl]carbamoyl}propyl]carbamate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:isopropyl [(1S)-2-methyl-1-{[(1RS)-1-p-tolylethyl]carbamoyl}propyl]carbamate', 'http://purl.obolibrary.org/obo/CHEBI_82023', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-Methylethyl <em>N</em>-[(1<em>S</em>)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]carbamate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:140923-17-7', 'https://commonchemistry.cas.org/detail?cas_rn=140923-17-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Carbamic acid, <em>N</em>-[(1<em>S</em>)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]-, 1-methylethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:140923-17-7', 'https://commonchemistry.cas.org/detail?cas_rn=140923-17-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Carbamic acid, [(1<em>S</em>)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]-, 1-methylethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:140923-17-7', 'https://commonchemistry.cas.org/detail?cas_rn=140923-17-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Fencaramid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:140923-17-7', 'https://commonchemistry.cas.org/detail?cas_rn=140923-17-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Iprovalicarb', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:140923-17-7', 'https://commonchemistry.cas.org/detail?cas_rn=140923-17-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'SZX 0722', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:140923-17-7', 'https://commonchemistry.cas.org/detail?cas_rn=140923-17-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=iprovalicarb(iso);isopropyl[(2s)-3-methyl-1-{[1-(4-methylphenyl)ethyl]amino}-1-oxobutan-2-yl]carbamate||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=140923-17-7; added Common Chemistry CAS names as altLabel: 1-Methylethyl <em>N</em>-[(1<em>S</em>)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]carbamate, Carbamic acid, <em>N</em>-[(1<em>S</em>)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]-, 1-methylethyl ester, Carbamic acid, [(1<em>S</em>)-2-methyl-1-[[[1-(4-methylphenyl)ethyl]amino]carbonyl]propyl]-, 1-methylethyl ester, Fencaramid, Iprovalicarb, SZX 0722; object_uuid=fo-0d03f690bf4c4c01
cas_match_labels None {'140923-17-7': 'exactMatch'} group_key=iprovalicarb(iso);isopropyl[(2s)-3-methyl-1-{[1-(4-methylphenyl)ethyl]amino}-1-oxobutan-2-yl]carbamate||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi']; cas_sources={'140923-17-7': ['chebi']}; assigned CAS labels from group consensus; object_uuid=fo-0d03f690bf4c4c01: {'140923-17-7': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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      "impact_category": "Non-cancer human health effects",
      "impact_indicator": "Comparative Toxic Unit for human (CTUh)",
      "characterization_factor": 2.4118e-6
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