ZMK

methyl 7-{[2-({N-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl]sulfanyl}-7-oxoheptanoate



Chemical Component Summary

Namemethyl 7-{[2-({N-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl]sulfanyl}-7-oxoheptanoate
Identifiersmethyl 7-[2-[3-[[(2S)-3,3-dimethyl-2-oxidanyl-4-phosphonooxy-butanoyl]amino]propanoylamino]ethylsulfanyl]-7-oxidanylidene-heptanoate
FormulaC19 H35 N2 O10 P S
Molecular Weight514.527
TypeNON-POLYMER
Isomeric SMILESCC(C)(COP(=O)(O)O)[C@@H](C(=O)NCCC(=O)NCCSC(=O)CCCCCC(=O)OC)O
InChIInChI=1S/C19H35N2O10PS/c1-19(2,13-31-32(27,28)29)17(25)18(26)21-10-9-14(22)20-11-12-33-16(24)8-6-4-5-7-15(23)30-3/h17,25H,4-13H2,1-3H3,(H,20,22)(H,21,26)(H2,27,28,29)/t17-/m1/s1
InChIKeyHCFLUHFHCAMJNF-QGZVFWFLSA-N

Chemical Details

Formal Charge0
Atom Count68
Chiral Atom Count1
Bond Count67
Aromatic Bond Count0

Related Resource References

Resource NameReference
PubChem 60210965