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CHEBI:198952 - Pamamycin-649B

ChEBI IDCHEBI:198952
ChEBI NamePamamycin-649B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H67NO7
Net Charge0
Average Mass649.954
Monoisotopic Mass649.49175
SMILESCCC[C@H](C[C@@H]1CC[C@H]([C@@H](CC)[C@@H]2OC(=O)[C@@H](C)[C@H]3CC[C@H](O3)[C@@H](C)[C@H](CCC)OC(=O)[C@H](CC)[C@H]3CC[C@H](O3)[C@H]2C)O1)N(C)C
InChIInChI=1S/C38H67NO7/c1-10-14-26(39(8)9)22-27-16-17-34(42-27)28(12-3)36-24(6)32-20-21-35(44-32)29(13-4)38(41)45-30(15-11-2)23(5)31-18-19-33(43-31)25(7)37(40)46-36/h23-36H,10-22H2,1-9H3/t23-,24+,25-,26+,27-,28+,29+,30-,31-,32-,33+,34+,35+,36+/m0/s1
InChIKeyMFMJBJLUIRYLLE-CTVFDYKESA-N
Species of MetaboliteComponentSourceComments
Streptomyces alboniger (ncbitaxon:132473) - DOI (10.1016/0040-4039(91)80696-4)
ChEBI Ontology
Outgoing Relation(s)
Pamamycin-649B (CHEBI:198952) is a macrolide (CHEBI:25106)
IUPAC Name 
(1R,2R,5S,6R,7S,10R,11S,14R,15R,16S)-14-[(1R)-1-[(2R,5S)-5-[(2R)-2-(dimethylamino)pentyl]oxolan-2-yl]propyl]-2-ethyl-6,11,15-trimethyl-5-propyl-4,13,19,20-tetraoxatricyclo[14.2.1.17,10]icosane-3,12-dione
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78436433ChemSpider