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CHEBI:204807 - Herbimycin E

ChEBI IDCHEBI:204807
ChEBI NameHerbimycin E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC30H42N2O10
Net Charge0
Average Mass590.670
Monoisotopic Mass590.28395
SMILESCO[C@H]1[C@@H](OC)C[C@H](C)[C@@H](OC)C2=CC(=O)C(=O)C(=C2O)NC(=O)/C(C)=C/C=C\[C@H](OC)[C@@H](OC(N)=O)/C(C)=C/[C@@H]1C
InChIInChI=1S/C30H42N2O10/c1-15-10-9-11-21(38-5)28(42-30(31)37)17(3)12-16(2)27(41-8)22(39-6)13-18(4)26(40-7)19-14-20(33)25(35)23(24(19)34)32-29(15)36/h9-12,14,16,18,21-22,26-28,34H,13H2,1-8H3,(H2,31,37)(H,32,36)/b11-9-,15-10+,17-12+/t16-,18-,21-,22-,26+,27+,28-/m0/s1
InChIKeyJPFKXBRAIMKSHO-PVMVKREDSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies RM-7-15 (ncbitaxon:1368692) - PubMed (23947794)
ChEBI Ontology
Outgoing Relation(s)
Herbimycin E (CHEBI:204807) is a azamacrocycle (CHEBI:52898)
Herbimycin E (CHEBI:204807) is a keratan 6'-sulfate (CHEBI:18331)
IUPAC Name 
[(4E,6Z,8S,9S,10E,12S,13R,14S,16S,17R)-22-hydroxy-8,13,14,17-tetramethoxy-4,10,12,16-tetramethyl-3,20,21-trioxo-2-azabicyclo[16.3.1]docosa-1(22),4,6,10,18-pentaen-9-yl] carbamate
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30819397ChemSpider