rosmarinic acid.hmbc
Chemical Info
InChI | InChI=1S/C18H16O8/c19-12-4-1-10(7-14(12)21)3-6-17(23)26-16(18(24)25)9-11-2-5-13(20)15(22)8-11/h1-8,16,19-22H,9H2,(H,24,25)/b6-3+/t16-/m1/s1 |
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SMILES | O=C(/C=C/C1=CC=C(O)C(O)=C1)O[C@H](CC1=CC=C(O)C(O)=C1)C(=O)O |
InChI Key | DOUMFZQKYFQNTF-WUTVXBCWSA-N |
Molecular Formula | C18H16O8 |
Exact Mass | 360.300 g/mol |
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Additional Information
Field | Value |
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Data last updated | April 22, 2024 |
Metadata last updated | April 22, 2024 |
Created | April 22, 2024 |
Format | HTML |
License | Attribution 4.0 International |
Id | 897c1a6f-2f70-4fe9-a086-b939de4be1c1 |
Package id | nmrxiv-d1326 |
Resource type | HTML |
State | active |