Trp-p-1 Acetate
fo-80eb226b16331fb2
Identity
- Type
- Molecular complex
- CAS
- 75104-43-7
- EC
- —
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 59 across every transformer
Structure
Alternative labels
3- 5H-Pyrido[4,3-b]indol-3-amine, 1,4-dimethyl-, acetate
- 5H-Pyrido[4,3-b]indol-3-amine, 1,4-dimethyl-, acetate (1:?)
- Acetate, Trp-P-1
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | UXNRBAJNAWIPGF-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C13H13N3.C2H4O2/c1-7-12-11(8(2)15-13(7)14)9-5-3-4-6-10(9)16-12;1-2(3)4/h3-6,16H,1-2H3,(H2,14,15);1H3,(H,3,4) |
| IUPAC name chemrof:IUPAC_name | 5H-Pyrido[4,3-b]indol-3-amine, 1,4-dimethyl-, acetate |
| Molecular formula chemrof:molecular_formula | C15H17N3O2 |
| Molecular mass chemrof:molecular_mass | 271.32 |
| Monoisotopic mass chemrof:monoisotopic_mass | 271.132077 |
| SMILES string chemrof:smiles_string | CC(=O)O.Cc1c(N)nc(C)c2c1[nH]c1ccccc12 |
Known URLs
5Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=75104-43-7 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.249.034 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID0021416 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/5284473 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q81976210 | enrich_references.pubchem_identifier_url |
Elementary flows
14| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 3e4d9ebd-6556-11dd-ad8b-0800200c9a66 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 08a91e70-3ddc-11dd-9a40-0050c2490048 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 02202b47-8d14-4cfe-96f3-fc45a33b62f2 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 08a91e70-3ddc-11dd-9a3f-0050c2490048 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 08a91e70-3ddc-11dd-9a41-0050c2490048 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 08a91e70-3ddc-11dd-9a3e-0050c2490048 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 08a91e70-3ddc-11dd-9a3c-0050c2490048 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| fe0acd60-3ddc-11dd-a4f9-0050c2490048 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 08a91e70-3ddc-11dd-9a3d-0050c2490048 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 08a91e70-3ddc-11dd-9a43-0050c2490048 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| fe0acd60-3ddc-11dd-a4fa-0050c2490048 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 08a91e70-3ddc-11dd-9a42-0050c2490048 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| e99fb14f844e340246a039e0f1d1765096d4cdfb | Environmental → Water → Unconfined aquifer | stepwise algorithm addition | kg | 0 |
| fe0acd60-3ddc-11dd-a4f8-0050c2490048 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (59 changes)
Full record
Flow object JSON
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