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CHEBI:212236 - Cytoglobosin I

ChEBI IDCHEBI:212236
ChEBI NameCytoglobosin I
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SubmitterMetaboLights
DownloadsMolfile
FormulaC32H40N2O6
Net Charge0
Average Mass548.680
Monoisotopic Mass548.28864
SMILESC/C1=C\[C@@H](C)C/C=C/[C@H]2[C@H](O)[C@](C)(O)[C@@H](C)[C@H]3[C@H](Cc4cnc5ccccc45)NC(=O)[C@]32C(=O)CC[C@@H](O)C1=O
InChIInChI=1S/C32H40N2O6/c1-17-8-7-10-22-29(38)31(4,40)19(3)27-24(15-20-16-33-23-11-6-5-9-21(20)23)34-30(39)32(22,27)26(36)13-12-25(35)28(37)18(2)14-17/h5-7,9-11,14,16-17,19,22,24-25,27,29,33,35,38,40H,8,12-13,15H2,1-4H3,(H,34,39)/b10-7+,18-14+/t17-,19-,22-,24-,25+,27-,29-,31+,32+/m0/s1
InChIKeyRDGPYVKATNNNKN-DNGZFULMSA-N
Species of MetaboliteComponentSourceComments
Chaetomium globosum (ncbitaxon:38033) - PubMed (27999388)
ChEBI Ontology
Outgoing Relation(s)
Cytoglobosin I (CHEBI:212236) is a indoles (CHEBI:24828)
IUPAC Name 
(1R,5R,7E,9S,11E,13R,14S,15R,16S,17R,18S)-5,14,15-trihydroxy-18-(1H-indol-3-ylmethyl)-7,9,15,16-tetramethyl-19-azatricyclo[11.7.0.01,17]icosa-7,11-diene-2,6,20-trione
Manual XrefsDatabases
78439225ChemSpider