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CHEBI:205267 - T988 B

ChEBI IDCHEBI:205267
ChEBI NameT988 B
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SubmitterMetaboLights
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FormulaC25H26N4O4S2
Net Charge0
Average Mass510.641
Monoisotopic Mass510.13955
SMILESCS[C@@]1(CO)C(=O)N2[C@H]3Nc4ccccc4[C@@]3(c3cnc4ccccc34)[C@H](O)[C@]2(SC)C(=O)N1C
InChIInChI=1S/C25H26N4O4S2/c1-28-22(33)25(35-3)19(31)24(16-12-26-17-10-6-4-8-14(16)17)15-9-5-7-11-18(15)27-20(24)29(25)21(32)23(28,13-30)34-2/h4-12,19-20,26-27,30-31H,13H2,1-3H3/t19-,20+,23-,24+,25-/m0/s1
InChIKeyZOGJUGRLERZFOU-DNRDEDMTSA-N
Species of MetaboliteComponentSourceComments
Tilachlidium (ncbitaxon:150389) - PubMed (15620259)
ChEBI Ontology
Outgoing Relation(s)
T988 B (CHEBI:205267) is a pyrroloindole (CHEBI:48133)
IUPAC Name 
(1R,4S,7S,8S,9R)-8-hydroxy-4-(hydroxymethyl)-9-(1H-indol-3-yl)-5-methyl-4,7-bis(methylsulanyl)-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-triene-3,6-dione
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9550585ChemSpider