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CHEBI:212543 - Tjipanazole C2

ChEBI IDCHEBI:212543
ChEBI NameTjipanazole C2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H21ClN2O4
Net Charge0
Average Mass436.895
Monoisotopic Mass436.11898
SMILESC[C@H]1O[C@@H](n2c3ccccc3c3ccc4c5cc(Cl)ccc5nc4c32)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C24H21ClN2O4/c1-11-21(28)22(29)23(30)24(31-11)27-18-5-3-2-4-13(18)15-8-7-14-16-10-12(25)6-9-17(16)26-19(14)20(15)27/h2-11,21-24,26,28-30H,1H3/t11-,21-,22+,23-,24-/m1/s1
InChIKeyXRSXGTRHWJQWIW-ISBJQNSRSA-N
Species of MetaboliteComponentSourceComments
Tolypothrix (ncbitaxon:111782) - DOI (10.1016/s0040-4020(01)81932-3)
ChEBI Ontology
Outgoing Relation(s)
Tjipanazole C2 (CHEBI:212543) is a indolocarbazole (CHEBI:51915)
IUPAC Name 
(2R,3R,4S,5S,6R)-2-(3-chloro-12H-indolo[2,3-a]carbazol-11-yl)-6-methyloxane-3,4,5-triol