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(1r,4r,5s)-6,6-dimethyl-4-(tribromomethyl)-3-oxabicyclo[3.1.0]hexan-2-one

UUID fc33c818-d356-436f-b23a-f01043a8a81f
Deprecated yes
Replaced By 7dd65fe2-3321-4e49-9a4e-8dfa03a96ecd
Flow Object IDfo-ff5613ca80973233
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 87305-03-1
EC Numbers 619-738-5
prefLabel
Language Value Provenance
en (1r,4r,5s)-6,6-dimethyl-4-(tribromomethyl)-3-oxabicyclo[3.1.0]hexan-2-one
altLabel ⓘ
Language Value Provenance
en (1<em>R</em>,4<em>R</em>,5<em>S</em>)-6,6-Dimethyl-4-(tribromomethyl)-3-oxabicyclo[3.1.0]hexan-2-one
en 3-Oxabicyclo[3.1.0]hexan-2-one, 6,6-dimethyl-4-(tribromomethyl)-, (1<em>R</em>,4<em>R</em>,5<em>S</em>)-
en 3-Oxabicyclo[3.1.0]hexan-2-one, 6,6-dimethyl-4-(tribromomethyl)-, [1<em>R</em>-(1α,4α,5α)]-
References
Shared Properties
Predicate Value
InChIKey ASKVAQUVJBPTBK-MROZADKFSA-N
InChI InChI=1S/C8H9Br3O2/c1-7(2)3-4(7)6(12)13-5(3)8(9,10)11/h3-5H,1-2H3/t3-,4+,5-/m1/s1
IUPAC name (1R,4R,5S)-6,6-dimethyl-4-(tribromomethyl)-3-oxabicyclo[3.1.0]hexan-2-one, (1R,4R,5S)-6,6-dimethyl-4-[tris(bromanyl)methyl]-3-oxabicyclo[3.1.0]hexan-2-one
Molecular formula C8H9Br3O2
SMILES CC1(C2C1C(=O)OC2C(Br)(Br)Br)C, CC1([C@@H]2[C@H]1C(=O)O[C@H]2C(Br)(Br)Br)C

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 fc33c818-d356-436f-b23a-f01043a8a81f (1r,4r,5s)-6,6-dimethyl-4-(tribromomethyl)-3-oxabicyclo[3.1.0]hexan-2-one

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=(1r,4r,5s)-6,6-dimethyl-4-(tribromomethyl)-3-oxabicyclo[3.1.0]hexan-2-one||dimension=Environmental > media=Ground > geography=Agricultural; cas=87305-03-1; added Common Chemistry CAS names as altLabel: (1<em>R</em>,4<em>R</em>,5<em>S</em>)-6,6-Dimethyl-4-(tribromomethyl)-3-oxabicyclo[3.1.0]hexan-2-one, 3-Oxabicyclo[3.1.0]hexan-2-one, 6,6-dimethyl-4-(tribromomethyl)-, (1<em>R</em>,4<em>R</em>,5<em>S</em>)-, 3-Oxabicyclo[3.1.0]hexan-2-one, 6,6-dimethyl-4-(tribromomethyl)-, [1<em>R</em>-(1α,4α,5α)]-; object_uuid=fo-ff5613ca80973233
cas_match_labels 1 — consensus_match group_key=(1r,4r,5s)-6,6-dimethyl-4-(tribromomethyl)-3-oxabicyclo[3.1.0]hexan-2-one||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'87305-03-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ff5613ca80973233: {'87305-03-1': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '(1<em>R</em>,4<em>R</em>,5<em>S</em>)-6,6-Dimethyl-4-(tribromomethyl)-3-oxabicyclo[3.1.0]hexan-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87305-03-1', 'https://commonchemistry.cas.org/detail?cas_rn=87305-03-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-Oxabicyclo[3.1.0]hexan-2-one, 6,6-dimethyl-4-(tribromomethyl)-, (1<em>R</em>,4<em>R</em>,5<em>S</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87305-03-1', 'https://commonchemistry.cas.org/detail?cas_rn=87305-03-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-Oxabicyclo[3.1.0]hexan-2-one, 6,6-dimethyl-4-(tribromomethyl)-, [1<em>R</em>-(1α,4α,5α)]-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87305-03-1', 'https://commonchemistry.cas.org/detail?cas_rn=87305-03-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=(1r,4r,5s)-6,6-dimethyl-4-(tribromomethyl)-3-oxabicyclo[3.1.0]hexan-2-one||dimension=Environmental > media=Ground > geography=Agricultural; cas=87305-03-1; added Common Chemistry CAS names as altLabel: (1<em>R</em>,4<em>R</em>,5<em>S</em>)-6,6-Dimethyl-4-(tribromomethyl)-3-oxabicyclo[3.1.0]hexan-2-one, 3-Oxabicyclo[3.1.0]hexan-2-one, 6,6-dimethyl-4-(tribromomethyl)-, (1<em>R</em>,4<em>R</em>,5<em>S</em>)-, 3-Oxabicyclo[3.1.0]hexan-2-one, 6,6-dimethyl-4-(tribromomethyl)-, [1<em>R</em>-(1α,4α,5α)]-; object_uuid=fo-ff5613ca80973233
cas_match_labels None {'87305-03-1': 'exactMatch'} group_key=(1r,4r,5s)-6,6-dimethyl-4-(tribromomethyl)-3-oxabicyclo[3.1.0]hexan-2-one||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'87305-03-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ff5613ca80973233: {'87305-03-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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