Search MNXref
 Feedback

ovothiol A

MNXM149148 is deprecated and here replaced by MNXM1368290
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1368290 Image of MNXM1368290
referencechebi:82723
formulaC7H11N3O2S
global charge0
mol weight201.251
InChIKeyXWKKYVJREGXHFO-BYPYZUCNSA-N
InChIInChI=1S/C7H11N3O2S/c1-10-3-9-6(13)5(10)2-4(8)7(11)12/h3-4,13H,2,8H2,1H3,(H,11,12)/t4-/m0/s1
SMILESCN1C=NC(S)=C1C[C@H]([NH3+])C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C7H11N3O2S/c1-10-3-9-6(13)5(10)2-4(8)7(11)12/h3-4,13H,2,8H2,1H3,(H,11,12)/t4-/m0/s1 Image of MNXM1368290
SMILES (mnx)[CH3:1][N:10]1[CH:3]=[N:9][C:6]([SH:13])=[C:5]1[CH2:2][C@@H:4]([C:7](=[O:11])[OH:12])[NH2:8]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:82723
chebi:82723
XWKKYVJREGXHFO-BYPYZUCNSA-N 		ovothiol A
(2S)-2-azaniumyl-3-(1-methyl-4-sulfanyl-1H-imidazol-5-yl)propanoate
N(1)-methyl-4-mercaptohistidine
ovothiol A zwitterion

metacyc.compound:CPD-17028
metacycM:CPD-17028
XWKKYVJREGXHFO-BYPYZUCNSA-N 		ovothiol

CHEBI:83318
chebi:83318
XWKKYVJREGXHFO-BYPYZUCNSA-N 		ovothiol A
1-N-Methyl-4-mercaptohistidine
3-methyl-5-sulfanyl-L-histidine
5-mercapto-3-methyl-L-histidine
5-mercapto-3-methylhistidine
L-Ovothiol A