Dataset
1-(2,3-dibenzimidazol-2-ylpropyl)-2-methoxybenzene
Chemical Info
InChI | InChI=1S/C24H22N4O/c1-29-22-13-7-2-8-16(22)14-17(24-27-20-11-5-6-12-21(20)28-24)15-23-25-18-9-3-4-10-19(18)26-23/h2-13,17H,14-15H2,1H3,(H,25,26)(H,27,28) |
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SMILES | COC1=CC=CC=C1CC(CC2=NC3=CC=CC=C3N2)C4=NC5=CC=CC=C5N4 |
InChI Key | FQFJIJMMCVBRBL-UHFFFAOYSA-N |
Molecular Formula | C24H22N4O |
Exact Mass | 382.179 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | |
License URL | https://creativecommons.org/licenses/by-sa/4.0 |
Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML80112 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T22:27:30.787667 |
MetadataModified | 2024-01-11T22:27:30.953348 |
MetadataPublished | 2016-01-19 |
Field | Value |
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Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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CHEMBL1359718 | ChEMBL |
1208557 | eMolecules |
141535 | ChEBI |
J3.555.082H | Nikkaji |
2907920 | PubChem |
SCHEMBL14029269 | SureChEMBL |
PD104004 | ProbesDrugs |
MCULE-8283587636 | Mcule |
The data in this table is sourced from UniChem at EBI. |