CHEBI:216380 - Macrotermycin A

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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 Macrotermycin A
ChEBI ID CHEBI:216380
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H36N2O6
Net Charge 0
Average Mass 472.582
Monoisotopic Mass 472.25734
InChI InChI=1S/C26H36N2O6/c1-19-13-9-7-5-3-4-6-8-10-14-21(34-25-23(27)24(31)20(29)18-33-25)26(2,32)16-12-11-15-22(30)28-17-19/h3-16,19-21,23-25,29,31-32H,17-18,27H2,1-2H3,(H,28,30)/b4-3-,7-5+,8-6+,13-9-,14-10-,15-11+,16-12+/t19-,20-,21+,23-,24+,25+,26-/m0/s1
InChIKey QAYDTFSWPPJOQZ-VDNKPNPHSA-N
SMILES O=C1NC[C@H](C=CC=CC=CC=CC=C[C@H]([C@](C=CC=C1)(O)C)O[C@H]2OC[C@H](O)[C@H]([C@@H]2N)O)C
Metabolite of Species Details
Amycolatopsisspecies M39 (NCBI:txid1825094) See: PubMed
ChEBI Ontology
Outgoing Macrotermycin A (CHEBI:216380) is a glycoside (CHEBI:24400)
IUPAC Name
(3E,5E,7S,8R,9Z,11E,13Z,15E,17Z,19S)-8-[(2R,3S,4S,5S)-3-amino-4,5-dihydroxyoxan-2-yl]oxy-7-hydroxy-7,19-dimethyl-1-azacycloicosa-3,5,9,11,13,15,17-heptaen-2-one
Manual Xref Database
78439307 ChemSpider
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