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Fatty Acids, C16-18 (even Numbered) And C18-unsatd., Tetraesters With 2,2-bis(hydroxymethyl)1,3-propanediol

UUID 9b80a995-2e15-45f0-b14c-5fc65e94f13f
Flow Object IDfo-0e2d4f7d1280de4d
Source EF 3.1
Context Environmental → Water → Surface water
CAS Numbers 19321-40-5
EC Numbers 242-960-5
prefLabel
Language Value Provenance
en Fatty Acids, C16-18 (even Numbered) And C18-unsatd., Tetraesters With 2,2-bis(hydroxymethyl)1,3-propanediol
altLabel
Language Value Provenance
en 9-Octadecenoic acid (9<em>Z</em>)-, 1,1′-[2,2-bis[[[(9<em>Z</em>)-1-oxo-9-octadecenyl]oxy]methyl]-1,3-propanediyl] ester
en 9-Octadecenoic acid (9<em>Z</em>)-, 2,2-bis[[[(9<em>Z</em>)-1-oxo-9-octadecenyl]oxy]methyl]-1,3-propanediyl ester
en 9-Octadecenoic acid (<em>Z</em>)-, 2,2-bis[[(1-oxo-9-octadecenyl)oxy]methyl]-1,3-propanediyl ester, (<em>Z</em>,<em>Z</em>)-
en Doverlube FL 219
en EW-Print 1041
en Estol 1445
en Liponate PO 4
en Oleic acid, neopentanetetrayl ester
en PS 2057
en Pentaerythritol, tetraoleate
en Pentaerythrityl tetraoleate
en Priolube 1445
en Puresyn 4E68
en Radia 7171
References
Shared Properties
Predicate Value
InChIKey QTIMEBJTEBWHOB-DXXRKCAZSA-N, QTIMEBJTEBWHOB-PMDAXIHYSA-N, QTIMEBJTEBWHOB-UHFFFAOYSA-N
InChI InChI=1S/C77H140O8/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-61-65-73(78)82-69-77(70-83-74(79)66-62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2,71-84-75(80)67-63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)72-85-76(81)68-64-60-56-52-48-44-40-36-32-28-24-20-16-12-8-4/h33-40H,5-32,41-72H2,1-4H3, InChI=1S/C77H140O8/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-61-65-73(78)82-69-77(70-83-74(79)66-62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2,71-84-75(80)67-63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)72-85-76(81)68-64-60-56-52-48-44-40-36-32-28-24-20-16-12-8-4/h33-40H,5-32,41-72H2,1-4H3/b37-33+,38-34+,39-35+,40-36+, InChI=1S/C77H140O8/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-61-65-73(78)82-69-77(70-83-74(79)66-62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2,71-84-75(80)67-63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)72-85-76(81)68-64-60-56-52-48-44-40-36-32-28-24-20-16-12-8-4/h33-40H,5-32,41-72H2,1-4H3/b37-33-,38-34-,39-35-,40-36-
IUPAC name (E)-9-octadecenoic acid [3-[(E)-1-oxooctadec-9-enoxy]-2,2-bis[[(E)-1-oxooctadec-9-enoxy]methyl]propyl] ester, (E)-octadec-9-enoic acid [3-[(E)-octadec-9-enoyl]oxy-2,2-bis[[(E)-octadec-9-enoyl]oxymethyl]propyl] ester, (Z)-9-octadecenoic acid [3-[(Z)-1-oxooctadec-9-enoxy]-2,2-bis[[(Z)-1-oxooctadec-9-enoxy]methyl]propyl] ester, (Z)-octadec-9-enoic acid [3-[(Z)-octadec-9-enoyl]oxy-2,2-bis[[(Z)-octadec-9-enoyl]oxymethyl]propyl] ester, 9-octadecenoic acid [3-(1-oxooctadec-9-enoxy)-2,2-bis(1-oxooctadec-9-enoxymethyl)propyl] ester, [3-[(E)-octadec-9-enoyl]oxy-2,2-bis[[(E)-octadec-9-enoyl]oxymethyl]propyl] (E)-octadec-9-enoate, [3-[(Z)-octadec-9-enoyl]oxy-2,2-bis[[(Z)-octadec-9-enoyl]oxymethyl]propyl] (Z)-octadec-9-enoate, [3-octadec-9-enoyloxy-2,2-bis(octadec-9-enoyloxymethyl)propyl] octadec-9-enoate, octadec-9-enoic acid [3-octadec-9-enoyloxy-2,2-bis(octadec-9-enoyloxymethyl)propyl] ester
Molecular formula C77H140O8
SMILES CCCCCCCC/C=C/CCCCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C/CCCCCCCC)(COC(=O)CCCCCCC/C=C/CCCCCCCC)COC(=O)CCCCCCC/C=C/CCCCCCCC, CCCCCCCC/C=C\CCCCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C\CCCCCCCC)(COC(=O)CCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCC/C=C\CCCCCCCC, CCCCCCCCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCCCCCCCC)(COC(=O)CCCCCCCC=CCCCCCCCC)COC(=O)CCCCCCCC=CCCCCCCCC

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 9b80a995-2e15-45f0-b14c-5fc65e94f13f fatty acids, c16-18 (even numbered) and c18-unsatd., tetraesters with 2,2-bis(hydroxymethyl)1,3-propanediol

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 fatty acids, c16-18 (even numbered) and c18-unsatd., tetraesters with 2,2-bis(hydroxymethyl)1,3-propanediol Emissions/Emissions to water/Emissions to fresh water 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=fattyacids,c16-18(evennumbered)andc18-unsatd.,tetraesterswith2,2-bis(hydroxymethyl)1,3-propanediol||dimension=Environmental > media=Air > indoor=Unknown; cas=19321-40-5; added Common Chemistry CAS names as altLabel: 9-Octadecenoic acid (9<em>Z</em>)-, 1,1′-[2,2-bis[[[(9<em>Z</em>)-1-oxo-9-octadecenyl]oxy]methyl]-1,3-propanediyl] ester, 9-Octadecenoic acid (9<em>Z</em>)-, 2,2-bis[[[(9<em>Z</em>)-1-oxo-9-octadecenyl]oxy]methyl]-1,3-propanediyl ester, 9-Octadecenoic acid (<em>Z</em>)-, 2,2-bis[[(1-oxo-9-octadecenyl)oxy]methyl]-1,3-propanediyl ester, (<em>Z</em>,<em>Z</em>)-, Doverlube FL 219, EW-Print 1041, Estol 1445, Liponate PO 4, Oleic acid, neopentanetetrayl ester, PS 2057, Pentaerythritol, tetraoleate, Pentaerythrityl tetraoleate, Priolube 1445, Puresyn 4E68, Radia 7171; object_uuid=fo-0e2d4f7d1280de4d
cas_match_labels 1 consensus_match group_key=fattyacids,c16-18(evennumbered)andc18-unsatd.,tetraesterswith2,2-bis(hydroxymethyl)1,3-propanediol||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory']; cas_sources={'19321-40-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0e2d4f7d1280de4d: {'19321-40-5': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodySurface water

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '9-Octadecenoic acid (9<em>Z</em>)-, 1,1′-[2,2-bis[[[(9<em>Z</em>)-1-oxo-9-octadecenyl]oxy]methyl]-1,3-propanediyl] ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:19321-40-5', 'https://commonchemistry.cas.org/detail?cas_rn=19321-40-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '9-Octadecenoic acid (9<em>Z</em>)-, 2,2-bis[[[(9<em>Z</em>)-1-oxo-9-octadecenyl]oxy]methyl]-1,3-propanediyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:19321-40-5', 'https://commonchemistry.cas.org/detail?cas_rn=19321-40-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '9-Octadecenoic acid (<em>Z</em>)-, 2,2-bis[[(1-oxo-9-octadecenyl)oxy]methyl]-1,3-propanediyl ester, (<em>Z</em>,<em>Z</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:19321-40-5', 'https://commonchemistry.cas.org/detail?cas_rn=19321-40-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Doverlube FL 219', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:19321-40-5', 'https://commonchemistry.cas.org/detail?cas_rn=19321-40-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'EW-Print 1041', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:19321-40-5', 'https://commonchemistry.cas.org/detail?cas_rn=19321-40-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Estol 1445', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:19321-40-5', 'https://commonchemistry.cas.org/detail?cas_rn=19321-40-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Liponate PO 4', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:19321-40-5', 'https://commonchemistry.cas.org/detail?cas_rn=19321-40-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Oleic acid, neopentanetetrayl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:19321-40-5', 'https://commonchemistry.cas.org/detail?cas_rn=19321-40-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'PS 2057', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:19321-40-5', 'https://commonchemistry.cas.org/detail?cas_rn=19321-40-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pentaerythritol, tetraoleate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:19321-40-5', 'https://commonchemistry.cas.org/detail?cas_rn=19321-40-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pentaerythrityl tetraoleate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:19321-40-5', 'https://commonchemistry.cas.org/detail?cas_rn=19321-40-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Priolube 1445', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:19321-40-5', 'https://commonchemistry.cas.org/detail?cas_rn=19321-40-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Puresyn 4E68', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:19321-40-5', 'https://commonchemistry.cas.org/detail?cas_rn=19321-40-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Radia 7171', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:19321-40-5', 'https://commonchemistry.cas.org/detail?cas_rn=19321-40-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=fattyacids,c16-18(evennumbered)andc18-unsatd.,tetraesterswith2,2-bis(hydroxymethyl)1,3-propanediol||dimension=Environmental > media=Air > indoor=Unknown; cas=19321-40-5; added Common Chemistry CAS names as altLabel: 9-Octadecenoic acid (9<em>Z</em>)-, 1,1′-[2,2-bis[[[(9<em>Z</em>)-1-oxo-9-octadecenyl]oxy]methyl]-1,3-propanediyl] ester, 9-Octadecenoic acid (9<em>Z</em>)-, 2,2-bis[[[(9<em>Z</em>)-1-oxo-9-octadecenyl]oxy]methyl]-1,3-propanediyl ester, 9-Octadecenoic acid (<em>Z</em>)-, 2,2-bis[[(1-oxo-9-octadecenyl)oxy]methyl]-1,3-propanediyl ester, (<em>Z</em>,<em>Z</em>)-, Doverlube FL 219, EW-Print 1041, Estol 1445, Liponate PO 4, Oleic acid, neopentanetetrayl ester, PS 2057, Pentaerythritol, tetraoleate, Pentaerythrityl tetraoleate, Priolube 1445, Puresyn 4E68, Radia 7171; object_uuid=fo-0e2d4f7d1280de4d
cas_match_labels None {'19321-40-5': 'exactMatch'} group_key=fattyacids,c16-18(evennumbered)andc18-unsatd.,tetraesterswith2,2-bis(hydroxymethyl)1,3-propanediol||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory']; cas_sources={'19321-40-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0e2d4f7d1280de4d: {'19321-40-5': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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