CHEBI:198419 - Roseothricin (H-277)

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ChEBI Name Roseothricin (H-277)
ChEBI ID CHEBI:198419
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information ZINC000004097885
Download Molfile XML SDF
Formula C18H37N7O6
Net Charge 0
Average Mass 447.537
Monoisotopic Mass 447.28053
InChI InChI=1S/C18H37N7O6/c19-4-1-2-11(21)6-15(29)24-12(16(30)13(28)3-5-26)7-22-17-23-8-14(25-17)18(31,9-20)10-27/h10-14,16,26,28,30-31H,1-9,19-21H2,(H,24,29)(H2,22,23,25)
InChIKey ZQUFOUIPSCWWOT-UHFFFAOYSA-N
SMILES O=C(NC(C(O)C(O)CCO)CNC1=NCC(N1)C(O)(C=O)CN)CC(N)CCCN
Metabolite of Species Details
Streptomyces roseochromogenus (NCBI:txid285450) See: DOI
ChEBI Ontology
Outgoing Roseothricin (H-277) (CHEBI:198419) has functional parent β-amino acid (CHEBI:33706)
Roseothricin (H-277) (CHEBI:198419) is a organonitrogen compound (CHEBI:35352)
Roseothricin (H-277) (CHEBI:198419) is a organooxygen compound (CHEBI:36963)
IUPAC Name
3,6-diamino-N-[1-[[5-(1-amino-2-hydroxy-3-oxopropan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]amino]-3,4,6-trihydroxyhexan-2-yl]hexanamide
Manual Xref Database
78443877 ChemSpider
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