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CHEBI:210511 - 3'-(hydroxyl(oxiran-2-yl)methoxy)-holyrine A

ChEBI IDCHEBI:210511
ChEBI Name3'-(hydroxyl(oxiran-2-yl)methoxy)-holyrine A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC29H28N4O5
Net Charge0
Average Mass512.566
Monoisotopic Mass512.20597
SMILESC[C@@H]1O[C@@H](n2c3ccccc3c3c4c(c5c6ccccc6nc5c32)CNC4=O)C[C@@H](N)[C@H]1OC(O)C1CO1
InChIInChI=1S/C29H28N4O5/c1-13-27(38-29(35)20-12-36-20)17(30)10-21(37-13)33-19-9-5-3-7-15(19)23-24-16(11-31-28(24)34)22-14-6-2-4-8-18(14)32-25(22)26(23)33/h2-9,13,17,20-21,27,29,32,35H,10-12,30H2,1H3,(H,31,34)/t13-,17+,20?,21+,27-,29?/m0/s1
InChIKeyOUQHIYLYXNEVEU-JKHXMZLYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (30268972)
ChEBI Ontology
Outgoing Relation(s)
3'-(hydroxyl(oxiran-2-yl)methoxy)-holyrine A (CHEBI:210511) is a indolocarbazole (CHEBI:51915)
IUPAC Name 
3-[(2R,4R,5R,6S)-4-amino-5-[hydroxy(oxiran-2-yl)methoxy]-6-methyloxan-2-yl]-3,13,23-triazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1,4,6,8,10,15,17,19,21-nonaen-12-one
Manual XrefsDatabases
71266943ChemSpider