EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C19H18O6S |
| Net Charge | 0 |
| Average Mass | 374.414 |
| Monoisotopic Mass | 374.08241 |
| SMILES | Cc1c(S(=O)(=O)O)oc2c1C(=O)C(=O)c1c-2ccc2c1CCCC2(C)C |
| InChI | InChI=1S/C19H18O6S/c1-9-13-15(20)16(21)14-10-5-4-8-19(2,3)12(10)7-6-11(14)17(13)25-18(9)26(22,23)24/h6-7H,4-5,8H2,1-3H3,(H,22,23,24) |
| InChIKey | UJCACMLMPLLRGW-UHFFFAOYSA-N |
| ChEBI Ontology |
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| Outgoing Relation(s) |
| tanshinone iia sulfonic acid (CHEBI:749916) is a abietane diterpenoid (CHEBI:36762) |
| Citations |
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