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CHEBI:219730 - Cirramycin A(1)

ChEBI IDCHEBI:219730
ChEBI NameCirramycin A(1)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H51NO10
Net Charge0
Average Mass597.746
Monoisotopic Mass597.35130
SMILESCCC1OC(=O)CC(O)C(C)C(OC2OC(C)C(O)C(N(C)C)C2O)C(CC=O)CC(C)C(=O)/C=C/C2(C)OC2C1C
InChIInChI=1S/C31H51NO10/c1-9-23-18(4)29-31(6,42-29)12-10-21(34)16(2)14-20(11-13-33)28(17(3)22(35)15-24(36)40-23)41-30-27(38)25(32(7)8)26(37)19(5)39-30/h10,12-13,16-20,22-23,25-30,35,37-38H,9,11,14-15H2,1-8H3/b12-10+
InChIKeyPYLRKBRNWXMGSG-ZRDIBKRKSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (5770857)
ChEBI Ontology
Outgoing Relation(s)
Cirramycin A(1) (CHEBI:219730) is a aminoglycoside (CHEBI:47779)
IUPAC Name 
2-[(14E)-9-[4-(dimethylamino)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3-ethyl-7-hydroxy-2,8,12,16-tetramethyl-5,13-dioxo-4,17-dioxabicyclo[14.1.0]heptadec-14-en-10-yl]acetaldehyde
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4513528ChemSpider