CHEBI:29623 - Manumycin A

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Manumycin A
ChEBI ID CHEBI:29623
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C31H38N2O7
Net Charge 0
Average Mass 550.644
Monoisotopic Mass 550.268
InChI InChI=1S/C31H38N2O7/c1-5-6-11-19(2)16-20(3)17-21(4)30(38)32-22-18-31(39,29-28(40-29)27(22)37)15-10-8-7-9-12-25(36)33-26-23(34)13-14-24(26)35/h7-10,12,15-19,28-29,34,39H,5-6,11,13-14H2,1-4H3,(H,32,38)(H,33,36)/b8-7+,12-9+,15-10+,20-16+,21-17+/t19-,28-,29-,31+/m1/s1
InChIKey TWWQHCKLTXDWBD-MVTGTTCWSA-N
SMILES CCCC[C@@H](C)\C=C(C)\C=C(/C)C(=O)NC1=C[C@@](O)(\C=C\C=C\C=C\C(=O)NC2=C(O)CCC2=O)[C@@H]2O[C@@H]2C1=O
ChEBI Ontology
Outgoing Manumycin A (CHEBI:29623) is a fatty amide (CHEBI:29348)
Synonyms Sources
Manumycin KEGG COMPOUND
Manumycin A KEGG COMPOUND
Manual Xref Database
C12111 KEGG COMPOUND
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Registry Number Type Source
52665-74-4 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014