Dataset
THYROTROPIN
Chemical Info
InChI | InChI=1S/C16H22N6O4/c17-14(24)12-2-1-5-22(12)16(26)11(6-9-7-18-8-19-9)21-15(25)10-3-4-13(23)20-10/h7-8,10-12H,1-6H2,(H2,17,24)(H,18,19)(H,20,23)(H,21,25) |
---|---|
SMILES | C1CC(N(C1)C(=O)C(CC2=CN=CN2)NC(=O)C3CCC(=O)N3)C(=O)N |
InChI Key | XNSAINXGIQZQOO-UHFFFAOYSA-N |
Molecular Formula | C16H22N6O4 |
Exact Mass | 362.170 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | |
License URL | |
Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_P102401_FB57 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T09:29:19.135963 |
MetadataModified | 2024-01-11T09:29:19.319451 |
MetadataPublished | 2021-12-14 |
Field | Value |
---|---|
Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
86214 | BindingDB |
MCULE-5812782214 | Mcule |
32281 | PubChem |
LSM-45252 | LINCS |
SCHEMBL8364920 | SureChEMBL |
10018211 | NMRShiftDB |
HMDB0259062 | Human Metabolome Database |
J707.434D | Nikkaji |
14779136 | PubChem: Thomson Pharma |
22365-02-2 | ACToR |
PD000196 | ProbesDrugs |
29541941 | eMolecules |
593334 | eMolecules |
The data in this table is sourced from UniChem at EBI. |