S-formylmycothiol

Properties MNX_ID MNXM1854 formula C18H30N2O13S charge 0 mass 514.50248 reference chebi:15735

InChIKey	JFPVMCRFDBEEHF-QFVXKRNMSA-N
InChI	InChI=1S/C18H30N2O13S/c1-5(23)19-6(3-34-4-22)17(31)20-8-10(25)9(24)7(2-21)32-18(8)33-16-14(29)12(27)11(26)13(28)15(16)30/h4,6-16,18,21,24-30H,2-3H2,1H3,(H,19,23)(H,20,31)/t6-,7+,8+,9+,10+,11-,12-,13+,14+,15+,16-,18+/m0/s1
SMILES	CC(=O)N[C@@H](CSC=O)C(=O)N[C@H]1[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O

Occurences in reactions

	#reac
Distinct reactions in my sandbox	0
Distinct generic reactions in MNXref	3
Distinct compatimentalized reactions in models	0

Similar chemical compounds in external resources

Identifier	Description
seedM:cpd04106	S-Formylmycothiol MSCH2OH S-formylmycothiol
metacycM:CPD1G-121	S-formylmycothiol MSCH2OH
keggC:C06718 sabiorkM:8863	S-Formylmycothiol
chebi:15735 reactome:R-ALL-879271	S-formylmycothiol (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl 2-[(N-acetyl-S-formyl-L-cysteinyl)amino]-2-deoxy-alpha-D-glucopyranoside 1D-1-O-[2-(N-acetyl-S-formyl-L-cysteinamido)-2-deoxy-alpha-D-glucopyranosyl]-myo-inositol S-Formylmycothiol
chebi:12765 chebi:22045 chebi:8957 keggC:M_C06718 seedM:M_cpd04106	secondary/obsolete/fantasy identifier
MNXM92323	is deprecated and replaced by this entry