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2,5-Dihydro-3,6-bis[4-(octadecylthio)phenyl]pyrrolo[3,4-c]pyrrole-1,4-dione

UUID 9ab076ad-19ed-4475-b209-202c72c9081d
Deprecated yes
Replaced By dd1d2b93-0e73-4e2d-93b2-b5eb852349bf
Flow Object IDfo-23bea637dd69af4e
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 247089-62-9
EC Numbers 433-930-4
prefLabel
Language Value Provenance
en 2,5-Dihydro-3,6-bis[4-(octadecylthio)phenyl]pyrrolo[3,4-c]pyrrole-1,4-dione
altLabel
Language Value Provenance
en 2,5-Dihydro-3,6-bis[4-(octadecylthio)phenyl]pyrrolo[3,4-<em>c</em>]pyrrole-1,4-dione
en Pyrrolo[3,4-<em>c</em>]pyrrole-1,4-dione, 2,5-dihydro-3,6-bis[4-(octadecylthio)phenyl]-
en 3,6-bis[4-(octadecylsulfanyl)phenyl]-1h,2h,4h,5h-pyrrolo[3,4-c]pyrrole-1,4-dione
References
Shared Properties
Predicate Value
InChIKey OECIMFUOKDGJQO-UHFFFAOYSA-N
InChI InChI=1S/C54H84N2O2S2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-43-59-47-39-35-45(36-40-47)51-49-50(54(58)55-51)52(56-53(49)57)46-37-41-48(42-38-46)60-44-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-42,55,58H,3-34,43-44H2,1-2H3
IUPAC name 1,4-bis(4-octadecylsulfanylphenyl)-3-oxidanyl-2H-pyrrolo[3,4-c]pyrrol-6-one, 3-hydroxy-1,4-bis(4-octadecylsulfanylphenyl)-2H-pyrrolo[3,4-c]pyrrol-6-one, 3-hydroxy-1,4-bis[4-(octadecylthio)phenyl]-2H-pyrrolo[3,4-c]pyrrol-6-one, 3-hydroxy-1,4-bis[4-(stearylthio)phenyl]-2H-pyrrolo[3,4-c]pyrrol-6-one
Molecular formula C54H84N2O2S2
SMILES CCCCCCCCCCCCCCCCCCSC1=CC=C(C=C1)C2=C3C(=C(N2)O)C(=NC3=O)C4=CC=C(C=C4)SCCCCCCCCCCCCCCCCCC

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 9ab076ad-19ed-4475-b209-202c72c9081d 3,6-bis[4-(octadecylsulfanyl)phenyl]-1h,2h,4h,5h-pyrrolo[3,4-c]pyrrole-1,4-dione

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=3,6-bis[4-(octadecylsulfanyl)phenyl]-1h,2h,4h,5h-pyrrolo[3,4-c]pyrrole-1,4-dione||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=247089-62-9; added Common Chemistry CAS names as altLabel: 2,5-Dihydro-3,6-bis[4-(octadecylthio)phenyl]pyrrolo[3,4-<em>c</em>]pyrrole-1,4-dione, Pyrrolo[3,4-<em>c</em>]pyrrole-1,4-dione, 2,5-dihydro-3,6-bis[4-(octadecylthio)phenyl]-; object_uuid=fo-23bea637dd69af4e
cas_match_labels 1 consensus_match group_key=3,6-bis[4-(octadecylsulfanyl)phenyl]-1h,2h,4h,5h-pyrrolo[3,4-c]pyrrole-1,4-dione||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=[]; cas_sources={'247089-62-9': []}; assigned CAS labels from group consensus; object_uuid=fo-23bea637dd69af4e: {'247089-62-9': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
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cas_match_labels None {'247089-62-9': 'exactMatch'} group_key=3,6-bis[4-(octadecylsulfanyl)phenyl]-1h,2h,4h,5h-pyrrolo[3,4-c]pyrrole-1,4-dione||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=[]; cas_sources={'247089-62-9': []}; assigned CAS labels from group consensus; object_uuid=fo-23bea637dd69af4e: {'247089-62-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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