EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:207650 - Neoantimycin B

ChEBI IDCHEBI:207650
ChEBI NameNeoantimycin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H37NO7
Net Charge0
Average Mass475.582
Monoisotopic Mass475.25700
SMILESCCCCCC[C@H]1C(=O)O[C@H](C)[C@H](NC(=O)c2ccccc2)C(=O)O[C@@H](C)[C@@H]1OC(=O)C(C)C
InChIInChI=1S/C26H37NO7/c1-6-7-8-12-15-20-22(34-24(29)16(2)3)18(5)33-26(31)21(17(4)32-25(20)30)27-23(28)19-13-10-9-11-14-19/h9-11,13-14,16-18,20-22H,6-8,12,15H2,1-5H3,(H,27,28)/t17-,18+,20-,21+,22+/m1/s1
InChIKeySSQVYIIIOZZEAD-UXJHKWJQSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (28358337)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Neoantimycin B (CHEBI:207650) is a N-acyl-amino acid (CHEBI:51569)
IUPAC Name 
[(2R,3S,6S,7R,8R)-3-benzamido-8-hexyl-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-7-yl] 2-methylpropanoate
Manual XrefsDatabases
61708463ChemSpider