Dataset
10-hydroxy-Camptothecin; LC-APCI-QTOF; MS; POSITIVE
Chemical Information
| InChI | InChI=1S/C20H16N2O5/c1-2-20(26)14-7-16-17-11(5-10-6-12(23)3-4-15(10)21-17)8-22(16)18(24)13(14)9-27-19(20)25/h3-7,23,26H,2,8-9H2,1H3/t20-/m0/s1 |
|---|---|
| SMILES | CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C(C3=C2)N=C5C=CC(=CC5=C4)O)O |
| InChI Key | HAWSQZCWOQZXHI-FQEVSTJZSA-N |
| Molecular Formula | C20H16N2O5 |
| Exact Mass | 364.106 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by-sa/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML82447 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataPublished | 2016-01-19 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| DB12385 | drugbank |
| CHEBI:81395 | chebi |
| CHEMBL273862 | chembl |
| 25875 | surechembl |
| 29350707 | surechembl |
| 97226 | pubchem |
| 9Z01632KRV | fdasrs |
| PD001274 | probes_and_drugs |
| YAWYAA | CCDC |
| 227935 | brenda |
| 29298 | brenda |
| Molport-002-317-316 | molport |
| 50008922 | bindingdb |
| The data in this table is sourced from UniChem at EBI. | |