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CHEBI:204743 - Neoantimycin E

ChEBI IDCHEBI:204743
ChEBI NameNeoantimycin E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC34H44N2O11
Net Charge0
Average Mass656.729
Monoisotopic Mass656.29451
SMILESCC(C)[C@@H]1OC(=O)[C@@H](NC(=O)c2cccc(N)c2O)[C@H](C)OC(=O)[C@H](C(C)C)OC(=O)C(C)(C)[C@@H](O)[C@@H](Cc2ccccc2)OC1=O
InChIInChI=1S/C34H44N2O11/c1-17(2)26-32(42)45-23(16-20-12-9-8-10-13-20)28(38)34(6,7)33(43)47-27(18(3)4)31(41)44-19(5)24(30(40)46-26)36-29(39)21-14-11-15-22(35)25(21)37/h8-15,17-19,23-24,26-28,37-38H,16,35H2,1-7H3,(H,36,39)/t19-,23+,24-,26-,27-,28-/m0/s1
InChIKeyCLRPGFXEJVHUEC-LIGOQVDJSA-N
Species of MetaboliteComponentSourceComments
Streptomyces orinoci (ncbitaxon:67339) - PubMed (23932359)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Neoantimycin E (CHEBI:204743) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
3-amino-N-[(3S,6S,7S,10S,14R,15R)-15-benzyl-14-hydroxy-7,13,13-trimethyl-2,5,9,12-tetraoxo-3,10-di(propan-2-yl)-1,4,8,11-tetraoxacyclopentadec-6-yl]-2-hydroxybenzamide
Manual XrefsDatabases
30825034ChemSpider