Mycothiol conjugate

Molecular Formula: C₁₇H₃₀N₂O₁₂S

InChI: InChI=1/C17H30N2O12S/c1-4(21)18-5(3-32)16(29)19-7-9(23)8(22)6(2-20)30-17(7)31-15-13(27)11(25)10(24)12(26)14(15)28/h5-15,17,20,22-28,32H,2-3H2,1H3,(H,18,21)(H,19,29)/f/h18-19H

InChIKey: InChIKey=MQBCDKMPXVYCGO-VEWCPZSHCM
SMILES: CC(=O)NC(CS)C(=O)NC1C(C(C(OC1OC2C(C(C(C(C2O)O)O)O)O)CO)O)O

Names:
    CPD1G-130
    MSR
    Mycothiol conjugate
    2-acetamido-N-[4,5-dihydroxy-6-(hydroxymethyl)-2-(2,3,4,5,6-pentahydroxycyclohexyl)oxy-oxan-3-yl]-3-sulfanyl-propanamide

Registries:
    PubChem CID 580
    PubChem ID 2540