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Harmaline

UUID 79dff3aa-d6c3-43fe-bdf3-084e94ef90e8
Flow Object IDfo-c1e6eb62637d8b0b
Source EF 3.1
Context Environmental → Air → Ground level → Rural (<1000 people/square mile)
CAS Numbers 304-21-2
EC Numbers 206-152-6
prefLabel
Language Value Provenance
en Harmaline
altLabel ⓘ
Language Value Provenance
en 3,4-Dihydroharmine
en 7-methoxy-1-methyl-4,9-dihydro-3H-beta-carboline
en 7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole
en Armalin
en Dihydroharmine
en Harmalol methyl ether
en Harmidine
en O-Methylharmalol
en harmalin
en 1-Methyl-7-methoxy-3,4-dihydro-β-carboline
en 3,4-Dihydro-7-methoxy-1-methyl-9<em>H</em>-pyrido[3,4-<em>b</em>]indole
en 3<em>H</em>-Pyrido[3,4-<em>b</em>]indole, 4,9-dihydro-7-methoxy-1-methyl-
en 4,9-Dihydro-7-methoxy-1-methyl-3<em>H</em>-pyrido[3,4-<em>b</em>]indole
en MeSH ID: D006246
en NSC 407285
Definitions
Language Value Provenance
en A harmala alkaloid in which the harman skeleton is methoxy-substituted at C-7 and has been reduced across the 3,4 bond.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey RERZNCLIYCABFS-UHFFFAOYSA-N
InChI InChI=1S/C13H14N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-4,7,15H,5-6H2,1-2H3
IUPAC name 7-methoxy-1-methyl-4,9-dihydro-3H-beta-carboline, 7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole
Molecular formula C13H14N2O
Molecular mass 214.268
Monoisotopic mass 214.11061
SMILES CC1=NCCC2=C1NC3=C2C=CC(=C3)OC, COc1ccc2c3c(nc2c1)C(C)=NCC3

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 79dff3aa-d6c3-43fe-bdf3-084e94ef90e8 harmaline

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 harmaline Emissions/Emissions to air/Emissions to air, unspecified (long-term) 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=harmaline||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=304-21-2; added Common Chemistry CAS names as altLabel: 1-Methyl-7-methoxy-3,4-dihydro-β-carboline, 3,4-Dihydro-7-methoxy-1-methyl-9<em>H</em>-pyrido[3,4-<em>b</em>]indole, 3<em>H</em>-Pyrido[3,4-<em>b</em>]indole, 4,9-dihydro-7-methoxy-1-methyl-, 4,9-Dihydro-7-methoxy-1-methyl-3<em>H</em>-pyrido[3,4-<em>b</em>]indole, MeSH ID: D006246, NSC 407285; object_uuid=fo-c1e6eb62637d8b0b
cas_match_labels 1 — consensus_match group_key=harmaline||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'304-21-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c1e6eb62637d8b0b: {'304-21-2': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataGround level
population_densityRural (<1000 people/square mile)

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '3,4-Dihydroharmine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3,4-Dihydroharmine', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '7-methoxy-1-methyl-4,9-dihydro-3H-beta-carboline', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:7-methoxy-1-methyl-4,9-dihydro-3H-beta-carboline', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Armalin', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Armalin', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Dihydroharmine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Dihydroharmine', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Harmalol methyl ether', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Harmalol methyl ether', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Harmidine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Harmidine', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'O-Methylharmalol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:O-Methylharmalol', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'harmalin', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:harmalin', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '3,4-Dihydroharmine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3,4-Dihydroharmine', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '7-methoxy-1-methyl-4,9-dihydro-3H-beta-carboline', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:7-methoxy-1-methyl-4,9-dihydro-3H-beta-carboline', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Armalin', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Armalin', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Dihydroharmine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Dihydroharmine', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Harmalol methyl ether', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Harmalol methyl ether', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Harmidine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Harmidine', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'O-Methylharmalol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:O-Methylharmalol', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'harmalin', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:harmalin', 'http://purl.obolibrary.org/obo/CHEBI_28172', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-Methyl-7-methoxy-3,4-dihydro-β-carboline', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:304-21-2', 'https://commonchemistry.cas.org/detail?cas_rn=304-21-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3,4-Dihydro-7-methoxy-1-methyl-9<em>H</em>-pyrido[3,4-<em>b</em>]indole', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:304-21-2', 'https://commonchemistry.cas.org/detail?cas_rn=304-21-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3<em>H</em>-Pyrido[3,4-<em>b</em>]indole, 4,9-dihydro-7-methoxy-1-methyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:304-21-2', 'https://commonchemistry.cas.org/detail?cas_rn=304-21-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4,9-Dihydro-7-methoxy-1-methyl-3<em>H</em>-pyrido[3,4-<em>b</em>]indole', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:304-21-2', 'https://commonchemistry.cas.org/detail?cas_rn=304-21-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'MeSH ID: D006246', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:304-21-2', 'https://commonchemistry.cas.org/detail?cas_rn=304-21-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 407285', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:304-21-2', 'https://commonchemistry.cas.org/detail?cas_rn=304-21-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=harmaline||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=304-21-2; added Common Chemistry CAS names as altLabel: 1-Methyl-7-methoxy-3,4-dihydro-β-carboline, 3,4-Dihydro-7-methoxy-1-methyl-9<em>H</em>-pyrido[3,4-<em>b</em>]indole, 3<em>H</em>-Pyrido[3,4-<em>b</em>]indole, 4,9-dihydro-7-methoxy-1-methyl-, 4,9-Dihydro-7-methoxy-1-methyl-3<em>H</em>-pyrido[3,4-<em>b</em>]indole, MeSH ID: D006246, NSC 407285; object_uuid=fo-c1e6eb62637d8b0b
cas_match_labels None {'304-21-2': 'exactMatch'} group_key=harmaline||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'304-21-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c1e6eb62637d8b0b: {'304-21-2': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
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  "name": null,
  "cas_numbers": [
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  ],
  "ec_numbers": [
    "206-152-6"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Air",
    "strata": "Ground level",
    "population_density": "Rural (<1000 people/square mile)"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [],
  "source": "EF 3.1",
  "identifier": "79dff3aa-d6c3-43fe-bdf3-084e94ef90e8",
  "input_datasets": [
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      "source_flow_name": "harmaline",
      "source_metadata": {
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        "input_dataset": "EF 3.1",
        "original_context": [
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          "Emissions to air, unspecified (long-term)"
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  "prefLabel": [
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