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CHEBI:226190 - Herbimycin D

ChEBI IDCHEBI:226190
ChEBI NameHerbimycin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H45N3O9S
Net Charge0
Average Mass647.791
Monoisotopic Mass647.28765
SMILESCO[C@H]1[C@@H](OC)C[C@H](C)[C@@H](OC)c2cc3c(c(c2O)NC(=O)/C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)/C(C)=C\[C@@H]1C)SCC(=O)N3
InChIInChI=1S/C32H45N3O9S/c1-16-10-9-11-22(40-5)29(44-32(33)39)18(3)12-17(2)28(43-8)23(41-6)13-19(4)27(42-7)20-14-21-30(45-15-24(36)34-21)25(26(20)37)35-31(16)38/h9-12,14,17,19,22-23,27-29,37H,13,15H2,1-8H3,(H2,33,39)(H,34,36)(H,35,38)/b11-9-,16-10-,18-12-/t17-,19-,22-,23-,27+,28+,29-/m0/s1
InChIKeyGYBQYXANPDPLKQ-QVTLGQBVSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies RM-7-15 (ncbitaxon:1368692) - PubMed (23947794)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
Herbimycin D (CHEBI:226190) is a benzothiazine (CHEBI:46899)
IUPAC Name 
[(2R,3S,5S,6R,7S,8Z,10S,11S,12Z,14Z)-26-hydroxy-2,5,6,11-tetramethoxy-3,7,9,15-tetramethyl-16,22-dioxo-20-thia-17,23-diazatricyclo[16.7.1.019,24]hexacosa-1(25),8,12,14,18(26),19(24)-hexaen-10-yl] carbamate
Manual XrefsDatabases
78440440ChemSpider