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CHEBI:45673 - S-ADENOSYLMETHIONINE METHYL ESTER

Default Structure
ChEBI IDCHEBI:45673
ChEBI NameS-ADENOSYLMETHIONINE METHYL ESTER
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC16H26N6O5S
Net Charge0
Average Mass414.488
Monoisotopic Mass414.16854
SMILES[H]O[C@@]1([H])[C@@]([H])(O[H])[C@]([H])(n2c([H])nc3c(N([H])[H])nc([H])nc32)O[C@]1([H])C([H])([H])[S@@]([H])(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]([H])(C(=O)OC([H])([H])[H])N([H])[H]
InChIInChI=1S/C16H26N6O5S/c1-26-16(25)8(17)3-4-28(2)5-9-11(23)12(24)15(27-9)22-7-21-10-13(18)19-6-20-14(10)22/h6-9,11-12,15,23-24,28H,3-5,17H2,1-2H3,(H2,18,19,20)/t8-,9+,11+,12+,15+/m0/s1
InChIKeyNAKVRMNIKCRDOL-OPYVMVOTSA-N
ChEBI Ontology
Outgoing Relation(s)
S-ADENOSYLMETHIONINE METHYL ESTER (CHEBI:45673) is a unclassifieds (CHEBI:27189)
Synonyms  Source
5'-[(S)-[(3S)-3-amino-4-methoxy-4-oxobutyl](methyl)-lambda~4~-sulfanyl]-5'-deoxyadenosinePDBeChem
S-ADENOSYLMETHIONINE METHYL ESTERPDBeChem
Manual XrefsDatabases
SMMPDBeChem