Dataset
Berberine annotated NMR 400 MHz DMSOd6 data.1d
Chemical Info
InChI | InChI=1S/C20H18NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-10H,5-6,11H2,1-2H3/q+1 |
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SMILES | COC1=C(OC)C2=C[N+]3=C(C=C2C=C1)C1=CC2=C(C=C1CC3)OCO2 |
InChI Key | YBHILYKTIRIUTE-UHFFFAOYSA-N |
Molecular Formula | [C20H18NO4]+ |
Exact Mass | 336.400 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.57992/nmrxiv.p33.s191.d865 |
License URL | https://creativecommons.org/publicdomain/zero/1.0/legalcode |
Source | https://nmrxiv.org/D865 |
Version | |
Author | Bisson J, McAlpine JB, Friesen JB, Chen SN, Graham J, Pauli GF. |
Maintainer | |
Language | english |
MetadataCreated | 2024-04-22T17:02:56.444572 |
MetadataModified | 2024-09-23T09:37:08.792907 |
MetadataPublished | 2023-12-21 14:26:13 |
Field | Value |
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Measurement Technique | 13C nuclear magnetic resonance spectroscopy |
Measurement Variables |
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