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CHEBI:221620 - Amycin B

ChEBI IDCHEBI:221620
ChEBI NameAmycin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC56H101N3O15
Net Charge0
Average Mass1056.430
Monoisotopic Mass1055.72327
SMILESCN=C(N)NCCC/C=C/CCCC(C)CC(C)C1OC(=O)C(C)C(O)/C=C\C(C)C(O)CC(O)C(C)C(O)CCC(C)C(O)CC2(O)OC(CC(O)CC(O)CC(O)C(C)C(O)/C=C\C=C/C1C)CC(O)C2O
InChIInChI=1S/C56H101N3O15/c1-33(18-14-12-10-11-13-17-25-59-55(57)58-9)26-37(5)52-36(4)19-15-16-20-44(62)38(6)48(66)29-42(61)27-41(60)28-43-30-50(68)53(70)56(72,74-43)32-51(69)35(3)22-23-45(63)39(7)49(67)31-47(65)34(2)21-24-46(64)40(8)54(71)73-52/h10-11,15-16,19-21,24,33-53,60-70,72H,12-14,17-18,22-23,25-32H2,1-9H3,(H3,57,58,59)/b11-10+,19-15-,20-16-,24-21-
InChIKeyPPUSZMZQPGFMIJ-VYPJZZTKSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (2257019)
ChEBI Ontology
Outgoing Relation(s)
Amycin B (CHEBI:221620) is a macrolide (CHEBI:25106)
IUPAC Name 
1-[(E)-11-[(10Z,12E,20E)-3,5,7,9,19,23,25,27,31,33,34,35-dodecahydroxy-8,14,18,22,26,30-hexamethyl-17-oxo-16,37-dioxabicyclo[31.3.1]heptatriaconta-10,12,20-trien-15-yl]-9-methyldodec-4-enyl]-2-methylguanidine
Manual XrefsDatabases
78444908ChemSpider