Dataset

Colchicine; LC-ESI-Q; MS; POS; 60 V

This MassBank record with Accession MSBNK-Waters-WA001569 contains the MS mass spectrum of Colchicine with the InChIkey IAKHMKGGTNLKSZ-INIZCTEOSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24)/t16-/m0/s1
SMILES COC(=C3)C(=O)C=C(C(NC(C)=O)2)C(=C3)c(c(CC2)1)c(OC)c(OC)c(OC)c1
InChI Key IAKHMKGGTNLKSZ-INIZCTEOSA-N
Molecular Formula C22H25NO6
Exact Mass 399.168 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA001569
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB01394 drugbank
    CHEBI:27882 chebi
    LOC rcsb_pdb
    CHEMBL107 chembl
    29374654 surechembl
    8469 surechembl
    6167 pubchem
    7JX9WZ3SJ5 fdasrs
    SML2Y3J35T fdasrs
    LOC pdbe
    PD002408 probes_and_drugs
    COLCDH CCDC
    229302 brenda
    229303 brenda
    3334 brenda
    48923 brenda
    8394 brenda
    DTXSID5024845 comptox
    NCT00000577 clinicaltrials
    NCT00004368 clinicaltrials
    NCT00004748 clinicaltrials
    NCT00128414 clinicaltrials
    NCT00128427 clinicaltrials
    NCT00128453 clinicaltrials
    NCT00179413 clinicaltrials
    NCT00235079 clinicaltrials
    NCT00370201 clinicaltrials
    NCT00370760 clinicaltrials
    NCT00506883 clinicaltrials
    NCT00700297 clinicaltrials
    NCT00723268 clinicaltrials
    NCT00754819 clinicaltrials
    NCT00819585 clinicaltrials
    NCT00840489 clinicaltrials
    NCT00960193 clinicaltrials
    NCT00960323 clinicaltrials
    NCT00983216 clinicaltrials
    NCT00983242 clinicaltrials
    NCT00983294 clinicaltrials
    NCT00983372 clinicaltrials
    NCT00983515 clinicaltrials
    NCT00983905 clinicaltrials
    NCT00983931 clinicaltrials
    NCT00984009 clinicaltrials
    NCT00984061 clinicaltrials
    NCT01001052 clinicaltrials
    NCT01005121 clinicaltrials
    NCT01017003 clinicaltrials
    NCT01017042 clinicaltrials
    NCT01018420 clinicaltrials
    NCT01021020 clinicaltrials
    NCT01021020 clinicaltrials
    NCT01040845 clinicaltrials
    NCT01075906 clinicaltrials
    NCT01084278 clinicaltrials
    NCT01112982 clinicaltrials
    NCT01123395 clinicaltrials
    NCT01130051 clinicaltrials
    NCT01160276 clinicaltrials
    NCT01173107 clinicaltrials
    NCT01266694 clinicaltrials
    NCT01336686 clinicaltrials
    NCT01399008 clinicaltrials
    NCT01416402 clinicaltrials
    NCT01451645 clinicaltrials
    NCT01481233 clinicaltrials
    NCT01552187 clinicaltrials
    NCT01601132 clinicaltrials
    NCT01709981 clinicaltrials
    NCT01755949 clinicaltrials
    NCT01906749 clinicaltrials
    NCT01935700 clinicaltrials
    NCT01936285 clinicaltrials
    NCT01985425 clinicaltrials
    NCT01994226 clinicaltrials
    NCT02060552 clinicaltrials
    NCT02063997 clinicaltrials
    NCT02083510 clinicaltrials
    NCT02122484 clinicaltrials
    NCT02128490 clinicaltrials
    NCT02139046 clinicaltrials
    NCT02140372 clinicaltrials
    NCT02162303 clinicaltrials
    NCT02175589 clinicaltrials
    NCT02176460 clinicaltrials
    NCT02177266 clinicaltrials
    NCT02252835 clinicaltrials
    NCT02260206 clinicaltrials
    NCT02281305 clinicaltrials
    NCT02282098 clinicaltrials
    NCT02330796 clinicaltrials
    NCT02366091 clinicaltrials
    NCT02442921 clinicaltrials
    NCT02500641 clinicaltrials
    NCT02551094 clinicaltrials
    NCT02582190 clinicaltrials
    NCT02594111 clinicaltrials
    NCT02602028 clinicaltrials
    NCT02624180 clinicaltrials
    NCT02898610 clinicaltrials
    NCT02926248 clinicaltrials
    NCT02939573 clinicaltrials
    NCT02995512 clinicaltrials
    NCT03015831 clinicaltrials
    NCT03021343 clinicaltrials
    NCT03048825 clinicaltrials
    NCT03128905 clinicaltrials
    NCT03131583 clinicaltrials
    NCT03156816 clinicaltrials
    NCT03226899 clinicaltrials
    NCT03310125 clinicaltrials
    NCT03376698 clinicaltrials
    NCT03575572 clinicaltrials
    NCT03693781 clinicaltrials
    NCT03888846 clinicaltrials
    NCT03905759 clinicaltrials
    NCT03913442 clinicaltrials
    NCT03933007 clinicaltrials
    NCT04008316 clinicaltrials
    NCT04056039 clinicaltrials
    NCT04130204 clinicaltrials
    NCT04160117 clinicaltrials
    NCT04181996 clinicaltrials
    NCT04218786 clinicaltrials
    NCT04224545 clinicaltrials
    NCT04264260 clinicaltrials
    NCT04322565 clinicaltrials
    NCT04322682 clinicaltrials
    NCT04324463 clinicaltrials
    NCT04326790 clinicaltrials
    NCT04328480 clinicaltrials
    NCT04350320 clinicaltrials
    NCT04355143 clinicaltrials
    NCT04355585 clinicaltrials
    NCT04359095 clinicaltrials
    NCT04360980 clinicaltrials
    NCT04363437 clinicaltrials
    NCT04367168 clinicaltrials
    NCT04375202 clinicaltrials
    NCT04381936 clinicaltrials
    NCT04382443 clinicaltrials
    NCT04392141 clinicaltrials
    NCT04403243 clinicaltrials
    NCT04416334 clinicaltrials
    NCT04420624 clinicaltrials
    NCT04472611 clinicaltrials
    NCT04492358 clinicaltrials
    NCT04500665 clinicaltrials
    NCT04510038 clinicaltrials
    NCT04516941 clinicaltrials
    NCT04539873 clinicaltrials
    NCT04601883 clinicaltrials
    NCT04603690 clinicaltrials
    NCT04667780 clinicaltrials
    NCT04705987 clinicaltrials
    NCT04724629 clinicaltrials
    NCT04756128 clinicaltrials
    NCT04762771 clinicaltrials
    NCT04774159 clinicaltrials
    NCT04818489 clinicaltrials
    NCT04848857 clinicaltrials
    NCT04857931 clinicaltrials
    NCT04867226 clinicaltrials
    NCT04870424 clinicaltrials
    NCT04875702 clinicaltrials
    NCT04906720 clinicaltrials
    NCT04916522 clinicaltrials
    NCT04949516 clinicaltrials
    NCT04997551 clinicaltrials
    NCT05017571 clinicaltrials
    NCT05118737 clinicaltrials
    NCT05130892 clinicaltrials
    NCT05151614 clinicaltrials
    NCT05159219 clinicaltrials
    NCT05162742 clinicaltrials
    NCT05168137 clinicaltrials
    NCT05175274 clinicaltrials
    NCT05200052 clinicaltrials
    NCT05246072 clinicaltrials
    NCT05250596 clinicaltrials
    NCT05253794 clinicaltrials
    NCT05279690 clinicaltrials
    NCT05324423 clinicaltrials
    NCT05335148 clinicaltrials
    NCT05347316 clinicaltrials
    NCT05439356 clinicaltrials
    NCT05459974 clinicaltrials
    NCT05472337 clinicaltrials
    NCT05476991 clinicaltrials
    NCT05503225 clinicaltrials
    NCT05618353 clinicaltrials
    NCT05633810 clinicaltrials
    NCT05637398 clinicaltrials
    NCT05677555 clinicaltrials
    NCT05698680 clinicaltrials
    NCT05709509 clinicaltrials
    NCT05726019 clinicaltrials
    NCT05734612 clinicaltrials
    NCT05737680 clinicaltrials
    NCT05739929 clinicaltrials
    NCT05802992 clinicaltrials
    NCT05850091 clinicaltrials
    NCT05855746 clinicaltrials
    NCT05873881 clinicaltrials
    NCT05890664 clinicaltrials
    NCT05928728 clinicaltrials
    NCT05936268 clinicaltrials
    NCT05949281 clinicaltrials
    NCT05956145 clinicaltrials
    NCT06020300 clinicaltrials
    NCT06025071 clinicaltrials
    NCT06054100 clinicaltrials
    NCT06062277 clinicaltrials
    NCT06078904 clinicaltrials
    NCT06081049 clinicaltrials
    NCT06090890 clinicaltrials
    NCT06095765 clinicaltrials
    NCT06102720 clinicaltrials
    NCT06118034 clinicaltrials
    NCT06130059 clinicaltrials
    NCT06158698 clinicaltrials
    NCT06203977 clinicaltrials
    NCT06212271 clinicaltrials
    NCT06217120 clinicaltrials
    NCT06270225 clinicaltrials
    NCT06279000 clinicaltrials
    NCT06280976 clinicaltrials
    NCT06286423 clinicaltrials
    NCT06304896 clinicaltrials
    NCT06342609 clinicaltrials
    NCT06396858 clinicaltrials
    NCT06426537 clinicaltrials
    NCT06469528 clinicaltrials
    NCT06472908 clinicaltrials
    Molport-001-742-594 molport
    726 drugcentral
    50014846 bindingdb
    The data in this table is sourced from UniChem at EBI.