MetaADEDB 2.0 @ LMMD
methanobactin
(XOADWJQVJWCREC-DZHAIUNBSA-N)
Structure
SMILES
CSCC[C@@H](C(=O)O)NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)Sc2nc([nH]c2O)C(=O)OC(C)C)CO)C(=O)N[C@@H](Cc2ccc(cc2)O)C(=O)N2C(c3[nH]c(C(=S)N[C@H](C(=O)N1)CO)c(O)n3)CCC2
Molecular Formula:
C44H58N12O16S5
Molecular Weight:
1171.330
Log P:
0.9858
Hydrogen Bond Acceptor:
31
Hydrogen Bond Donor:
15
TPSA:
562.34
CAS Number(s):
N/A
Synonym(s)
1.
methanobactin
External Link(s)
MeSHC491147
PubChem Compound135659045
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Liver diseases21364284CTD
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