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N-Undec-10-enoylphenylalanine

Flow Object IDfo-027f593e04e6e667
TypeConsensus
prefLabel
Label Language
N-Undec-10-enoylphenylalanine en
Alt Labels
Label Language Provenance
2-(undec-10-enoylamino)-3-phenylpropanoic Acid en
CAS Numbers420805-16-9
EC Numbers446-800-7
Changes Applied13

Properties

Predicate Value
InChIKey RTBWWWVNZWFNBV-UHFFFAOYSA-N
InChI InChI=1S/C20H29NO3/c1-2-3-4-5-6-7-8-12-15-19(22)21-18(20(23)24)16-17-13-10-9-11-14-17/h2,9-11,13-14,18H,1,3-8,12,15-16H2,(H,21,22)(H,23,24)
IUPAC name 2-(1-oxoundec-10-enylamino)-3-phenylpropanoic acid, 3-phenyl-2-(undec-10-enoylamino)propanoic acid, 3-phenyl-2-(undec-10-enoylamino)propionic acid
Molecular formula C20H29NO3
SMILES C=CCCCCCCCCC(=O)NC(CC1=CC=CC=C1)C(=O)O

References

Linked Elementary Flows

UUID Source Unit Context LCIA Factors Consensus Changes
4faccc1d… EF 3.1 kg Environmental → Air → Aircraft cruise height 2 1
795168c9… EF 3.1 kg Environmental → Air → Ground level → Rural (<1000 people/square mile) 0 1
4f2a5485… EF 3.1 kg Environmental → Air → Ground level → Urban (>1000 people/square mile) 2 1
0254c449… EF 3.1 kg Environmental → Air → High stack, >150 meters 2 1
0d4bb43c… EF 3.1 kg Environmental → Air → Unknown 2 1
fee75e55… EF 3.1 kg Environmental → Air → Unknown 2 1
31e1b9ae… EF 3.1 kg Environmental → Ground → Agricultural 2 1
4b855390… EF 3.1 kg Environmental → Ground → Unknown 2 1
4293a3a0… EF 3.1 kg Environmental → Water → Ocean 2 1
8c1a6b4b… EF 3.1 kg Environmental → Water → Surface water 2 1
c2e40538… EF 3.1 kg Environmental → Water → Unknown 2 1

Changes Applied

Elementary Flow Field Old Value New Value Comment
0254c449… cas_match_labels {"420805-16-9":"exactMatch"} group_key=2-(undec-10-enoylamino)-3-phenylpropanoicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'420805-16-9': []}; assigned CAS labels from group consensus; object_uuid=fo-027f593e04e6e667: {'420805-16-9': 'exactMatch'}
0d4bb43c… cas_match_labels {"420805-16-9":"exactMatch"} group_key=2-(undec-10-enoylamino)-3-phenylpropanoicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'420805-16-9': []}; assigned CAS labels from group consensus; object_uuid=fo-027f593e04e6e667: {'420805-16-9': 'exactMatch'}
31e1b9ae… cas_match_labels {"420805-16-9":"exactMatch"} group_key=2-(undec-10-enoylamino)-3-phenylpropanoicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'420805-16-9': []}; assigned CAS labels from group consensus; object_uuid=fo-027f593e04e6e667: {'420805-16-9': 'exactMatch'}
4293a3a0… cas_match_labels {"420805-16-9":"exactMatch"} group_key=2-(undec-10-enoylamino)-3-phenylpropanoicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'420805-16-9': []}; assigned CAS labels from group consensus; object_uuid=fo-027f593e04e6e667: {'420805-16-9': 'exactMatch'}
4b855390… cas_match_labels {"420805-16-9":"exactMatch"} group_key=2-(undec-10-enoylamino)-3-phenylpropanoicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'420805-16-9': []}; assigned CAS labels from group consensus; object_uuid=fo-027f593e04e6e667: {'420805-16-9': 'exactMatch'}
4f2a5485… cas_match_labels {"420805-16-9":"exactMatch"} group_key=2-(undec-10-enoylamino)-3-phenylpropanoicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'420805-16-9': []}; assigned CAS labels from group consensus; object_uuid=fo-027f593e04e6e667: {'420805-16-9': 'exactMatch'}
4faccc1d… cas_match_labels {"420805-16-9":"exactMatch"} group_key=2-(undec-10-enoylamino)-3-phenylpropanoicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'420805-16-9': []}; assigned CAS labels from group consensus; object_uuid=fo-027f593e04e6e667: {'420805-16-9': 'exactMatch'}
6b686d4c… cas_match_labels {"420805-16-9":"exactMatch"} group_key=2-(undec-10-enoylamino)-3-phenylpropanoicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'420805-16-9': []}; assigned CAS labels from group consensus; object_uuid=fo-027f593e04e6e667: {'420805-16-9': 'exactMatch'}
795168c9… cas_match_labels {"420805-16-9":"exactMatch"} group_key=2-(undec-10-enoylamino)-3-phenylpropanoicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'420805-16-9': []}; assigned CAS labels from group consensus; object_uuid=fo-027f593e04e6e667: {'420805-16-9': 'exactMatch'}
8c1a6b4b… cas_match_labels {"420805-16-9":"exactMatch"} group_key=2-(undec-10-enoylamino)-3-phenylpropanoicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'420805-16-9': []}; assigned CAS labels from group consensus; object_uuid=fo-027f593e04e6e667: {'420805-16-9': 'exactMatch'}
c2e40538… cas_match_labels {"420805-16-9":"exactMatch"} group_key=2-(undec-10-enoylamino)-3-phenylpropanoicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'420805-16-9': []}; assigned CAS labels from group consensus; object_uuid=fo-027f593e04e6e667: {'420805-16-9': 'exactMatch'}
ed2fa9cd… cas_match_labels {"420805-16-9":"exactMatch"} group_key=2-(undec-10-enoylamino)-3-phenylpropanoicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'420805-16-9': []}; assigned CAS labels from group consensus; object_uuid=fo-027f593e04e6e667: {'420805-16-9': 'exactMatch'}
fee75e55… cas_match_labels {"420805-16-9":"exactMatch"} group_key=2-(undec-10-enoylamino)-3-phenylpropanoicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'420805-16-9': []}; assigned CAS labels from group consensus; object_uuid=fo-027f593e04e6e667: {'420805-16-9': 'exactMatch'}

Flow Object JSON

{
  "flow_object_id": "fo-027f593e04e6e667",
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    {
      "@value": "N-Undec-10-enoylphenylalanine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "prefLabel"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2-(undec-10-enoylamino)-3-phenylpropanoic Acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "altLabel"
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  ],
  "properties": {
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      "@value": [
        "C20H29NO3"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": {
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        "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
      }
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
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      "@value": [
        "RTBWWWVNZWFNBV-UHFFFAOYSA-N"
      ],
      "rdfs:label": "InChIKey",
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        "prov:wasDerivedFrom": "pubchem.props.InChIKey"
      }
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "C=CCCCCCCCCC(=O)NC(CC1=CC=CC=C1)C(=O)O"
      ],
      "rdfs:label": "SMILES",
      "provenance": {
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        "prov:wasDerivedFrom": "pubchem.props.SMILES"
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C20H29NO3/c1-2-3-4-5-6-7-8-12-15-19(22)21-18(20(23)24)16-17-13-10-9-11-14-17/h2,9-11,13-14,18H,1,3-8,12,15-16H2,(H,21,22)(H,23,24)"
      ],
      "rdfs:label": "InChI",
      "provenance": {
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        "prov:wasDerivedFrom": "pubchem.props.InChI"
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    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "2-(1-oxoundec-10-enylamino)-3-phenylpropanoic acid",
        "3-phenyl-2-(undec-10-enoylamino)propanoic acid",
        "3-phenyl-2-(undec-10-enoylamino)propionic acid"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
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        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
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    }
  },
  "references": [
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    {
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    {
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        "prov:wasDerivedFrom": "pubchem.by_cas[420805-16-9]"
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    {
      "@id": "https://www.wikidata.org/wiki/Q126611898",
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  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "0254c449-9af4-410e-9e12-d854432b9f37",
    "seed_source": "EF 3.1"
  },
  "classifications": {
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      "@value": [
        "420805-16-9"
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      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=420805-16-9"
      ],
      "skos:exactMatch": [
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      ],
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        "prov:wasDerivedFrom": "ec_numbers"
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  },
  "origin_qualifier": null,
  "parent_flow_object_id": null
}