Mercurial > repos > computational-metabolomics > sirius_csifingerid
view test-data/canopus_CCMSLIB00000578155_result.tsv @ 6:96b077221201 draft
"planemo upload for repository https://github.com/computational-metabolomics/sirius_csifingerid_galaxy commit a1dfcf9fe850298b80f3738611835a3ef53e820a"
author | computational-metabolomics |
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date | Fri, 04 Feb 2022 17:13:46 +0000 |
parents | 4cbfd3d0a4c4 |
children |
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name adduct name molecularFormula adduct most specific class level 5 subclass class superclass all classifications D-GLUCOSE-6-PHOSPHATE [M-H]- D-GLUCOSE-6-PHOSPHATE C6H13O9P [M-H]- Hexose phosphates Monosaccharides Carbohydrates and carbohydrate conjugates Organooxygen compounds Organic oxygen compounds Organic compounds; Organoheterocyclic compounds; Carbohydrates and carbohydrate conjugates; Alcohols and polyols; Ethers; Organic acids and derivatives; Organooxygen compounds; Organic phosphoric acids and derivatives; Phosphate esters; Hemiacetals; Hexoses; Monosaccharides; Monosaccharide phosphates; Secondary alcohols; Oxanes; Hexose phosphates; Polyols; Alkyl phosphates; Monoalkyl phosphates; Organic oxides; Oxacyclic compounds; Hydrocarbon derivatives; Organic oxygen compounds; Chemical entities