Ezetimibe Intermediate

← Back to consensus flows

UUID bc12c216-4a44-482a-862d-0b1310f01c01

Deprecated yes

Replaced By 1fc4acc9-1da0-497d-af4a-e86308034657

Flow Object ID fo-8cb6595de75a655a

Source EF 3.1

Context Environmental → Ground → Unknown

CAS Numbers 189028-93-1

EC Numbers 480-320-9

prefLabel

Language	Value	Provenance
`en`	`Ezetimibe Intermediate`

altLabel ⓘ

Language	Value	Provenance
`en`	`(4<em>S</em>)-4-Phenyl-3-[5-(4-fluorophenyl)-5-oxopentanoyl]-1,3-oxazolidin-2-one`
`en`	`(<em>S</em>)-1-(4-Fluorophenyl)-5-(2-oxo-4-phenyloxazolidin-3-yl)pentane-1,5-dione`
`en`	`(<em>S</em>)-3-[4-(4-Fluorobenzoyl)-1-oxobutyl]-4-phenyloxazolidin-2-one`
`en`	`(<em>S</em>)-3-[5-(4-Fluorophenyl)-1,5-dioxopentyl]-4-phenyloxazolidin-2-one`
`en`	`1,5-Pentanedione, 1-(4-fluorophenyl)-5-[(4<em>S</em>)-2-oxo-4-phenyl-3-oxazolidinyl]-`
`en`	`1-(4-Fluorophenyl)-5-[(4<em>S</em>)-2-oxo-4-phenyl-3-oxazolidinyl]-1,5-pentanedione`
`en`	`1-(4-Fluorophenyl)-5-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]pentane-1,5-dione`
`en`	`2-Oxazolidinone, 3-[5-(4-fluorophenyl)-1,5-dioxopentyl]-4-phenyl-, (4<em>S</em>)-`
`en`	`2-Oxazolidinone, 3-[5-(4-fluorophenyl)-1,5-dioxopentyl]-4-phenyl-, (<em>S</em>)-`

References

Shared Properties

Predicate	Value
InChIKey	`XXSSRSVXDNUAQX-KRWDZBQOSA-N, XXSSRSVXDNUAQX-QGZVFWFLSA-N, XXSSRSVXDNUAQX-UHFFFAOYSA-N`
InChI	`InChI=1S/C20H18FNO4/c21-16-11-9-15(10-12-16)18(23)7-4-8-19(24)22-17(13-26-20(22)25)14-5-2-1-3-6-14/h1-3,5-6,9-12,17H,4,7-8,13H2, InChI=1S/C20H18FNO4/c21-16-11-9-15(10-12-16)18(23)7-4-8-19(24)22-17(13-26-20(22)25)14-5-2-1-3-6-14/h1-3,5-6,9-12,17H,4,7-8,13H2/t17-/m0/s1, InChI=1S/C20H18FNO4/c21-16-11-9-15(10-12-16)18(23)7-4-8-19(24)22-17(13-26-20(22)25)14-5-2-1-3-6-14/h1-3,5-6,9-12,17H,4,7-8,13H2/t17-/m1/s1`
IUPAC name	1-(4-fluorophenyl)-5-(2-keto-4-phenyl-oxazolidin-3-yl)pentane-1,5-dione, 1-(4-fluorophenyl)-5-(2-oxidanylidene-4-phenyl-1,3-oxazolidin-3-yl)pentane-1,5-dione, 1-(4-fluorophenyl)-5-(2-oxo-4-phenyl-1,3-oxazolidin-3-yl)pentane-1,5-dione, 1-(4-fluorophenyl)-5-(2-oxo-4-phenyl-3-oxazolidinyl)pentane-1,5-dione, 1-(4-fluorophenyl)-5-(2-oxo-4-phenyl-oxazolidin-3-yl)pentane-1,5-dione, 1-(4-fluorophenyl)-5-[(4R)-2-keto-4-phenyl-oxazolidin-3-yl]pentane-1,5-dione, 1-(4-fluorophenyl)-5-[(4R)-2-oxidanylidene-4-phenyl-1,3-oxazolidin-3-yl]pentane-1,5-dione, 1-(4-fluorophenyl)-5-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]pentane-1,5-dione, 1-(4-fluorophenyl)-5-[(4R)-2-oxo-4-phenyl-3-oxazolidinyl]pentane-1,5-dione, 1-(4-fluorophenyl)-5-[(4R)-2-oxo-4-phenyl-oxazolidin-3-yl]pentane-1,5-dione, 1-(4-fluorophenyl)-5-[(4S)-2-keto-4-phenyl-oxazolidin-3-yl]pentane-1,5-dione, 1-(4-fluorophenyl)-5-[(4S)-2-oxidanylidene-4-phenyl-1,3-oxazolidin-3-yl]pentane-1,5-dione, 1-(4-fluorophenyl)-5-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]pentane-1,5-dione, 1-(4-fluorophenyl)-5-[(4S)-2-oxo-4-phenyl-3-oxazolidinyl]pentane-1,5-dione, 1-(4-fluorophenyl)-5-[(4S)-2-oxo-4-phenyl-oxazolidin-3-yl]pentane-1,5-dione
Molecular formula	`C20H18FNO4`
SMILES	`C1C(N(C(=O)O1)C(=O)CCCC(=O)C2=CC=C(C=C2)F)C3=CC=CC=C3, C1[C@@H](N(C(=O)O1)C(=O)CCCC(=O)C2=CC=C(C=C2)F)C3=CC=CC=C3, C1[C@H](N(C(=O)O1)C(=O)CCCC(=O)C2=CC=C(C=C2)F)C3=CC=CC=C3`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`bc12c216-4a44-482a-862d-0b1310f01c01`	ezetimibe intermediate

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=ezetimibeintermediate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=189028-93-1; added Common Chemistry CAS names as altLabel: (4<em>S</em>)-4-Phenyl-3-[5-(4-fluorophenyl)-5-oxopentanoyl]-1,3-oxazolidin-2-one, (<em>S</em>)-1-(4-Fluorophenyl)-5-(2-oxo-4-phenyloxazolidin-3-yl)pentane-1,5-dione, (<em>S</em>)-3-[4-(4-Fluorobenzoyl)-1-oxobutyl]-4-phenyloxazolidin-2-one, (<em>S</em>)-3-[5-(4-Fluorophenyl)-1,5-dioxopentyl]-4-phenyloxazolidin-2-one, 1,5-Pentanedione, 1-(4-fluorophenyl)-5-[(4<em>S</em>)-2-oxo-4-phenyl-3-oxazolidinyl]-, 1-(4-Fluorophenyl)-5-[(4<em>S</em>)-2-oxo-4-phenyl-3-oxazolidinyl]-1,5-pentanedione, 1-(4-Fluorophenyl)-5-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]pentane-1,5-dione, 2-Oxazolidinone, 3-[5-(4-fluorophenyl)-1,5-dioxopentyl]-4-phenyl-, (4<em>S</em>)-, 2-Oxazolidinone, 3-[5-(4-fluorophenyl)-1,5-dioxopentyl]-4-phenyl-, (<em>S</em>)-; object_uuid=fo-8cb6595de75a655a
`cas_match_labels`	1	`—`	consensus_match	group_key=ezetimibeintermediate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=[]; cas_sources={'189028-93-1': []}; assigned CAS labels from group consensus; object_uuid=fo-8cb6595de75a655a: {'189028-93-1': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Ground
geography	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '(4<em>S</em>)-4-Phenyl-3-[5-(4-fluorophenyl)-5-oxopentanoyl]-1,3-oxazolidin-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:189028-93-1', 'https://commonchemistry.cas.org/detail?cas_rn=189028-93-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(<em>S</em>)-1-(4-Fluorophenyl)-5-(2-oxo-4-phenyloxazolidin-3-yl)pentane-1,5-dione', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:189028-93-1', 'https://commonchemistry.cas.org/detail?cas_rn=189028-93-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(<em>S</em>)-3-[4-(4-Fluorobenzoyl)-1-oxobutyl]-4-phenyloxazolidin-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:189028-93-1', 'https://commonchemistry.cas.org/detail?cas_rn=189028-93-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(<em>S</em>)-3-[5-(4-Fluorophenyl)-1,5-dioxopentyl]-4-phenyloxazolidin-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:189028-93-1', 'https://commonchemistry.cas.org/detail?cas_rn=189028-93-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,5-Pentanedione, 1-(4-fluorophenyl)-5-[(4<em>S</em>)-2-oxo-4-phenyl-3-oxazolidinyl]-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:189028-93-1', 'https://commonchemistry.cas.org/detail?cas_rn=189028-93-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1-(4-Fluorophenyl)-5-[(4<em>S</em>)-2-oxo-4-phenyl-3-oxazolidinyl]-1,5-pentanedione', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:189028-93-1', 'https://commonchemistry.cas.org/detail?cas_rn=189028-93-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1-(4-Fluorophenyl)-5-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]pentane-1,5-dione', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:189028-93-1', 'https://commonchemistry.cas.org/detail?cas_rn=189028-93-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Oxazolidinone, 3-[5-(4-fluorophenyl)-1,5-dioxopentyl]-4-phenyl-, (4<em>S</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:189028-93-1', 'https://commonchemistry.cas.org/detail?cas_rn=189028-93-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Oxazolidinone, 3-[5-(4-fluorophenyl)-1,5-dioxopentyl]-4-phenyl-, (<em>S</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:189028-93-1', 'https://commonchemistry.cas.org/detail?cas_rn=189028-93-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=ezetimibeintermediate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=189028-93-1; added Common Chemistry CAS names as altLabel: (4<em>S</em>)-4-Phenyl-3-[5-(4-fluorophenyl)-5-oxopentanoyl]-1,3-oxazolidin-2-one, (<em>S</em>)-1-(4-Fluorophenyl)-5-(2-oxo-4-phenyloxazolidin-3-yl)pentane-1,5-dione, (<em>S</em>)-3-[4-(4-Fluorobenzoyl)-1-oxobutyl]-4-phenyloxazolidin-2-one, (<em>S</em>)-3-[5-(4-Fluorophenyl)-1,5-dioxopentyl]-4-phenyloxazolidin-2-one, 1,5-Pentanedione, 1-(4-fluorophenyl)-5-[(4<em>S</em>)-2-oxo-4-phenyl-3-oxazolidinyl]-, 1-(4-Fluorophenyl)-5-[(4<em>S</em>)-2-oxo-4-phenyl-3-oxazolidinyl]-1,5-pentanedione, 1-(4-Fluorophenyl)-5-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]pentane-1,5-dione, 2-Oxazolidinone, 3-[5-(4-fluorophenyl)-1,5-dioxopentyl]-4-phenyl-, (4<em>S</em>)-, 2-Oxazolidinone, 3-[5-(4-fluorophenyl)-1,5-dioxopentyl]-4-phenyl-, (<em>S</em>)-; object_uuid=fo-8cb6595de75a655a
`cas_match_labels`	`None`	`{'189028-93-1': 'exactMatch'}`	group_key=ezetimibeintermediate\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=[]; cas_sources={'189028-93-1': []}; assigned CAS labels from group consensus; object_uuid=fo-8cb6595de75a655a: {'189028-93-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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        "1-(4-fluorophenyl)-5-(2-oxo-4-phenyl-1,3-oxazolidin-3-yl)pentane-1,5-dione",
        "1-(4-fluorophenyl)-5-(2-oxo-4-phenyl-3-oxazolidinyl)pentane-1,5-dione",
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        "1-(4-fluorophenyl)-5-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]pentane-1,5-dione",
        "1-(4-fluorophenyl)-5-[(4R)-2-oxo-4-phenyl-3-oxazolidinyl]pentane-1,5-dione",
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        "1-(4-fluorophenyl)-5-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]pentane-1,5-dione",
        "1-(4-fluorophenyl)-5-[(4S)-2-oxo-4-phenyl-3-oxazolidinyl]pentane-1,5-dione",
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