Dataset
SI_Outreach_4_2F_column_lime_05312024_300.cosy
Chemical Info
InChI | InChI=1S/C3H8/c1-3-2/h3H2,1-2H3 |
---|---|
SMILES | CCC |
InChI Key | ATUOYWHBWRKTHZ-UHFFFAOYSA-N |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.57992/nmrxiv.p78.s636.d3300 |
License URL | https://creativecommons.org/licenses/by-nc-sa/4.0/legalcode |
Source | https://nmrxiv.org/D3300 |
Version | |
Author | |
Maintainer | |
Language | english |
MetadataCreated | 2025-02-03T16:26:04.383482 |
MetadataModified | 2025-02-03T16:26:04.383488 |
MetadataPublished | 2024-08-02 19:43:39 |
Field | Value |
---|---|
Measurement Technique | correlation spectroscopy |
Measurement Variables |
|
Data-Source Molecule ID | Data-Source |
---|---|
15218585 | PubChem: Thomson Pharma |
68527-16-2 | ACToR |
68476-49-3 | ACToR |
68606-26-8 | ACToR |
68475-58-1 | ACToR |
68920-07-0 | ACToR |
74-98-6 | ACToR |
68476-40-4 | ACToR |
6334 | PubChem |
T75W9911L6 | FDA SRS |
PD117486 | ProbesDrugs |
495596 | eMolecules |
CB2194886 | ChemicalBook |
32879 | Rhea |
HMDB0031630 | Human Metabolome Database |
107585 | Brenda |
21284 | NMRShiftDB |
MCULE-7179517367 | Mcule |
SCHEMBL1021 | SureChEMBL |
TME | PDBe |
32879 | ChEBI |
CHEMBL135416 | ChEMBL |
JAYDUI | CCDC |
J1.530.844C | Nikkaji |
J2.385J | Nikkaji |
DTXSID5026386 | EPA CompTox Dashboard |
7275 | Brenda |
PROPANE | clinicaltrials |
225697 | Brenda |
PROPANE | rxnorm |
CB4156796 | ChemicalBook |
The data in this table is sourced from UniChem at EBI. |