← Back to consensus flow objects
Glyceryl caprylate-caprate
| Flow Object ID | fo-0afe4c7268ccaa5d | |||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Type | Consensus | |||||||||||||||
| prefLabel |
|
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| Alt Labels |
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| Definitions |
|
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| CAS Numbers | 73398-61-5 | |||||||||||||||
| EC Numbers | 277-452-2 | |||||||||||||||
| Changes Applied | 13 |
Properties
| Predicate | Value |
|---|---|
| Formal charge |
-1
|
| InChIKey |
YWHITOKQSMJXEA-UHFFFAOYSA-M
|
| InChI |
InChI=1S/C21H40O6/c1-2-3-4-10-13-18(21(26)27-17-19(23)16-22)14-11-8-6-5-7-9-12-15-20(24)25/h18-19,22-23H,2-17H2,1H3,(H,24,25)/p-1
|
| IUPAC name |
11-(2,3-dihydroxypropoxycarbonyl)heptadecanoate, 11-[2,3-bis(oxidanyl)propoxycarbonyl]heptadecanoate, 11-[2,3-dihydroxypropoxy(oxo)methyl]heptadecanoate, 11-glyceryloxycarbonylheptadecanoate
|
| Molecular formula |
C21H39O6, C21H39O6-
|
| Molecular mass |
387.537
|
| Monoisotopic mass |
387.27521
|
| SMILES |
CCCCCCC(CCCCCCCCCC(=O)[O-])C(=O)OCC(CO)O, CCCCCCC(CCCCCCCCCC(=O)[O-])C(=O)OCC(O)CO
|
References
- https://commonchemistry.cas.org/detail?cas_rn=73398-61-5
- https://pubchem.ncbi.nlm.nih.gov/compound/91757308
- https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:232552
- https://www.wikidata.org/wiki/Q72461627
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
20fc0443… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 4 | 1 |
aaba05f3… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 1 |
efbebe9e… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 4 | 1 |
5b764d33… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 4 | 1 |
5fbf5d25… |
EF 3.1 | kg | Environmental → Air → Unknown | 4 | 1 |
bd13f170… |
EF 3.1 | kg | Environmental → Air → Unknown | 4 | 1 |
058e7903… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 4 | 1 |
55646677… |
EF 3.1 | kg | Environmental → Ground → Unknown | 4 | 1 |
0e5352a6… |
EF 3.1 | kg | Environmental → Water → Ocean | 4 | 1 |
fee8f6c0… |
EF 3.1 | kg | Environmental → Water → Surface water | 4 | 1 |
777f07f3… |
EF 3.1 | kg | Environmental → Water → Unknown | 4 | 1 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
058e7903… |
cas_match_labels |
— |
{"73398-61-5":"exactMatch"} |
group_key=glycerides,mixeddecanoylandoctanoyl||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'73398-61-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0afe4c7268ccaa5d: {'73398-61-5': 'exactMatch'} |
0e5352a6… |
cas_match_labels |
— |
{"73398-61-5":"exactMatch"} |
group_key=glycerides,mixeddecanoylandoctanoyl||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'73398-61-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0afe4c7268ccaa5d: {'73398-61-5': 'exactMatch'} |
20fc0443… |
cas_match_labels |
— |
{"73398-61-5":"exactMatch"} |
group_key=glycerides,mixeddecanoylandoctanoyl||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'73398-61-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0afe4c7268ccaa5d: {'73398-61-5': 'exactMatch'} |
55646677… |
cas_match_labels |
— |
{"73398-61-5":"exactMatch"} |
group_key=glycerides,mixeddecanoylandoctanoyl||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'73398-61-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0afe4c7268ccaa5d: {'73398-61-5': 'exactMatch'} |
5b764d33… |
cas_match_labels |
— |
{"73398-61-5":"exactMatch"} |
group_key=glycerides,mixeddecanoylandoctanoyl||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'73398-61-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0afe4c7268ccaa5d: {'73398-61-5': 'exactMatch'} |
5dee9139… |
cas_match_labels |
— |
{"73398-61-5":"exactMatch"} |
group_key=glycerides,mixeddecanoylandoctanoyl||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'73398-61-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0afe4c7268ccaa5d: {'73398-61-5': 'exactMatch'} |
5fbf5d25… |
cas_match_labels |
— |
{"73398-61-5":"exactMatch"} |
group_key=glycerides,mixeddecanoylandoctanoyl||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'73398-61-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0afe4c7268ccaa5d: {'73398-61-5': 'exactMatch'} |
777f07f3… |
cas_match_labels |
— |
{"73398-61-5":"exactMatch"} |
group_key=glycerides,mixeddecanoylandoctanoyl||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'73398-61-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0afe4c7268ccaa5d: {'73398-61-5': 'exactMatch'} |
aaba05f3… |
cas_match_labels |
— |
{"73398-61-5":"exactMatch"} |
group_key=glycerides,mixeddecanoylandoctanoyl||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'73398-61-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0afe4c7268ccaa5d: {'73398-61-5': 'exactMatch'} |
bc8f888b… |
cas_match_labels |
— |
{"73398-61-5":"exactMatch"} |
group_key=glycerides,mixeddecanoylandoctanoyl||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'73398-61-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0afe4c7268ccaa5d: {'73398-61-5': 'exactMatch'} |
bd13f170… |
cas_match_labels |
— |
{"73398-61-5":"exactMatch"} |
group_key=glycerides,mixeddecanoylandoctanoyl||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'73398-61-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0afe4c7268ccaa5d: {'73398-61-5': 'exactMatch'} |
efbebe9e… |
cas_match_labels |
— |
{"73398-61-5":"exactMatch"} |
group_key=glycerides,mixeddecanoylandoctanoyl||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'73398-61-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0afe4c7268ccaa5d: {'73398-61-5': 'exactMatch'} |
fee8f6c0… |
cas_match_labels |
— |
{"73398-61-5":"exactMatch"} |
group_key=glycerides,mixeddecanoylandoctanoyl||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory']; cas_sources={'73398-61-5': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0afe4c7268ccaa5d: {'73398-61-5': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-0afe4c7268ccaa5d",
"prefLabel": [
{
"@value": "Glyceryl caprylate-caprate",
"@language": "en",
"@lang": "en",
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}
],
"altLabel": [
{
"@value": "Caprylic/capric triglyceride",
"@language": "en",
"@lang": "en",
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}
},
{
"@value": "Glycerides, Mixed Decanoyl And Octanoyl",
"@language": "en",
"@lang": "en",
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{
"@value": "Mixed decanoyl octanoyl glycerides",
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},
{
"@value": "Triglycerides, medium-chain",
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],
"properties": {
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"C21H39O6",
"C21H39O6-"
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"rdfs:label": "Molecular formula",
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},
"https://w3id.org/chemrof/smiles_string": {
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"@value": [
"CCCCCCC(CCCCCCCCCC(=O)[O-])C(=O)OCC(CO)O",
"CCCCCCC(CCCCCCCCCC(=O)[O-])C(=O)OCC(O)CO"
],
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"https://w3id.org/chemrof/inchi2d_string": {
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},
"https://w3id.org/chemrof/monoisotopic_mass": {
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"https://w3id.org/chemrof/formal_charge": {
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"@value": [
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"origin_qualifier": null,
"parent_flow_object_id": null,
"skos:definition": [
{
"@value": "Caprylic/capric triglyceride is a natural coconut and palm kernel oil derived mixture ofglycerin triester with caprylic and capric acids, which can be used as an alternative to mineral and vegetable oils. It is a mixed ester composed of caprylic and capric fatty acids attached to a glycerin backbone.",
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