D7L
6-hydroxy-16-methoxy-11-methyl-2-oxa-11-azatetracyclo[8.6.1.03,8.013,17]heptadeca-1(16),3,5,7,9,13(17),14-heptaen-12-one
Created: | 2019-07-12 |
Last modified: | 2020-07-08 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 35 |
Chiral Atom Count | 0 |
Bond Count | 38 |
Aromatic Bond Count | 12 |
Chemical Component Summary | |
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Name | 6-hydroxy-16-methoxy-11-methyl-2-oxa-11-azatetracyclo[8.6.1.03,8.013,17]heptadeca-1(16),3,5,7,9,13(17),14-heptaen-12-one |
Formula | C17 H13 N O4 |
Molecular Weight | 295.289 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | COc1ccc2C(=O)N(C)C3=Cc4cc(O)ccc4Oc1c23 |
SMILES | OpenEye OEToolkits | 2.0.7 | CN1C2=Cc3cc(ccc3Oc4c2c(ccc4OC)C1=O)O |
Canonical SMILES | CACTVS | 3.385 | COc1ccc2C(=O)N(C)C3=Cc4cc(O)ccc4Oc1c23 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | CN1C2=Cc3cc(ccc3Oc4c2c(ccc4OC)C1=O)O |
InChI | InChI | 1.03 | InChI=1S/C17H13NO4/c1-18-12-8-9-7-10(19)3-5-13(9)22-16-14(21-2)6-4-11(15(12)16)17(18)20/h3-8,19H,1-2H3 |
InChIKey | InChI | 1.03 | UBXAIPVYSJZJCU-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 146673480 |