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CHEBI:83210 - (S)-mandestrobin

ChEBI IDCHEBI:83210
ChEBI Name(S)-mandestrobin
Stars
ASCII Name(S)-mandestrobin
DefinitionA 2-{2-[(2,5-dimethylphenoxy)methyl]phenyl}-2-methoxy-N-methylacetamide that is the (S)-enantiomer of mandestrobin.
Last Modified13 October 2014
SubmitterSteve
DownloadsMolfile
FormulaC19H23NO3
Net Charge0
Average Mass313.397
Monoisotopic Mass313.16779
SMILESCNC(=O)[C@@H](OC)c1ccccc1COc1cc(C)ccc1C
InChIInChI=1S/C19H23NO3/c1-13-9-10-14(2)17(11-13)23-12-15-7-5-6-8-16(15)18(22-4)19(21)20-3/h5-11,18H,12H2,1-4H3,(H,20,21)/t18-/m0/s1
InChIKeyPDPWCKVFIFAQIQ-SFHVURJKSA-N
ChEBI Ontology
Outgoing Relation(s)
(S)-mandestrobin (CHEBI:83210) is a 2-{2-[(2,5-dimethylphenoxy)methyl]phenyl}-2-methoxy-N-methylacetamide (CHEBI:83208)
(S)-mandestrobin (CHEBI:83210) is enantiomer of (R)-mandestrobin (CHEBI:83209)
Incoming Relation(s)
mandestrobin (CHEBI:83205) has part (S)-mandestrobin (CHEBI:83210)
(R)-mandestrobin (CHEBI:83209) is enantiomer of (S)-mandestrobin (CHEBI:83210)
IUPAC Name 
(2S)-2-{2-[(2,5-dimethylphenoxy)methyl]phenyl}-2-methoxy-N-methylacetamide