CHEBI:219230 - Pamamycin 621A

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Pamamycin 621A
ChEBI ID CHEBI:219230
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C36H63NO7
Net Charge 0
Average Mass 621.900
Monoisotopic Mass 621.46045
InChI InChI=1S/C36H63NO7/c1-10-12-26(37(8)9)20-27-14-15-30(40-27)22(4)34-23(5)31-17-19-32(42-31)24(6)35(38)43-28(13-11-2)21(3)29-16-18-33(41-29)25(7)36(39)44-34/h21-34H,10-20H2,1-9H3/t21-,22+,23+,24+,25-,26+,27-,28-,29-,30+,31-,32+,33+,34-/m0/s1
InChIKey MMFMMXXZYTWNGM-ZZSWZHNPSA-N
SMILES O=C1O[C@H]([C@@H]([C@H]2O[C@@H]([C@H](C(=O)O[C@H]([C@@H]([C@H]3O[C@@H]([C@@H]1C)CC3)C)CCC)C)CC2)C)[C@@H]([C@@H]4O[C@H](C[C@H](N(C)C)CCC)CC4)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing Pamamycin 621A (CHEBI:219230) is a macrolide (CHEBI:25106)
IUPAC Name
(1R,2S,5S,6R,7S,10R,11R,14S,15R,16S)-5-[(1R)-1-[(2R,5S)-5-[(2R)-2-(dimethylamino)pentyl]oxolan-2-yl]ethyl]-2,6,11,15-tetramethyl-14-propyl-4,13,19,20-tetraoxatricyclo[14.2.1.17,10]icosane-3,12-dione
Manual Xref Database
8683538 ChemSpider
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