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3-O-Ethylascorbic acid

UUID c0487796-eeb9-4450-95d3-df9a9ebbf5b0
Flow Object IDfo-ee38d914afbab234
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 86404-04-8
EC Numbers 617-849-3
prefLabel
Language Value Provenance
en 3-O-Ethylascorbic acid
altLabel
Language Value Provenance
en (2R)-2-[(1S)-1,2-dihydroxyethyl]-3-ethoxy-4-hydroxy-2H-uran-5-one
en 3-<em>O</em>-Ethyl-<span class="text-smallcaps">L</span>-ascorbic acid
en 3-<em>O</em>-Ethylascorbic acid
en <span class="text-smallcaps">L</span>-Ascorbic acid 3-<em>O</em>-ethyl ether
en <span class="text-smallcaps">L</span>-Ascorbic acid, 3-<em>O</em>-ethyl-
en COS-VCE
en ENB-VCE
en Specwhite VCE
en VC Ethyl
en (5r)-5-[(1s)-1,2-dihydroxyethyl]-4-ethoxy-3-hydroxy-5h-furan-2-one
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey ZGSCRDSBTNQPMS-UJURSFKZSA-N
InChI InChI=1S/C8H12O6/c1-2-13-7-5(11)8(12)14-6(7)4(10)3-9/h4,6,9-11H,2-3H2,1H3/t4-,6+/m0/s1
IUPAC name (2R)-2-[(1S)-1,2-bis(oxidanyl)ethyl]-3-ethoxy-4-oxidanyl-2H-furan-5-one, (2R)-2-[(1S)-1,2-dihydroxyethyl]-3-ethoxy-4-hydroxy-2H-furan-5-one
Molecular formula C8H12O6
Molecular mass 204.178
Monoisotopic mass 204.06339
SMILES CCOC1=C(C(=O)OC1C(CO)O)O, CCOC1=C(C(=O)O[C@@H]1[C@H](CO)O)O, [H][C@]1([C@@H](O)CO)OC(=O)C(O)=C1OCC

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 c0487796-eeb9-4450-95d3-df9a9ebbf5b0 (5r)-5-[(1s)-1,2-dihydroxyethyl]-4-ethoxy-3-hydroxy-5h-furan-2-one

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 (5r)-5-[(1s)-1,2-dihydroxyethyl]-4-ethoxy-3-hydroxy-5h-furan-2-one Emissions/Emissions to soil/Emissions to soil, 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=(5r)-5-[(1s)-1,2-dihydroxyethyl]-4-ethoxy-3-hydroxy-5h-furan-2-one||dimension=Environmental > media=Air > strata=Unknown; cas=86404-04-8; added Common Chemistry CAS names as altLabel: 3-<em>O</em>-Ethyl-<span class="text-smallcaps">L</span>-ascorbic acid, 3-<em>O</em>-Ethylascorbic acid, <span class="text-smallcaps">L</span>-Ascorbic acid 3-<em>O</em>-ethyl ether, <span class="text-smallcaps">L</span>-Ascorbic acid, 3-<em>O</em>-ethyl-, COS-VCE, ENB-VCE, Specwhite VCE, VC Ethyl; object_uuid=fo-ee38d914afbab234
cas_match_labels 1 consensus_match group_key=(5r)-5-[(1s)-1,2-dihydroxyethyl]-4-ethoxy-3-hydroxy-5h-furan-2-one||dimension=Environmental > media=Air > strata=Unknown; group_sources=['chebi']; cas_sources={'86404-04-8': ['chebi']}; assigned CAS labels from group consensus; object_uuid=fo-ee38d914afbab234: {'86404-04-8': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
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cas_match_labels None {'86404-04-8': 'exactMatch'} group_key=(5r)-5-[(1s)-1,2-dihydroxyethyl]-4-ethoxy-3-hydroxy-5h-furan-2-one||dimension=Environmental > media=Air > strata=Unknown; group_sources=['chebi']; cas_sources={'86404-04-8': ['chebi']}; assigned CAS labels from group consensus; object_uuid=fo-ee38d914afbab234: {'86404-04-8': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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