Compound ID | 1753

Update compound information

Goldinomycin

Synonym(s): Aurodox

Class: Antivirulence agent (T3SS)

Spectrum of activity: Gram-negative
Details of activity: Active against C. rodentium; Map inhibitor
Year first mentioned: 2020
Highest developmental phase: Preclinical
Chemical structure(s):
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Molecular weight: 810.97
Iso. SMILES: CC[C@H](C(=O)NC/C=C/C=C(\C)/[C@H]([C@@H](C)[C@H]1[C@H]([C@H]([C@H](O1)/C=C/C=C/C=C(\C)/C(=O)C2=C(C=CN(C2=O)C)O)O)O)OC)[C@@]3([C@@H]([C@@H](C([C@@H](O3)/C=C/C=C\C)(C)C)O)O)O
InChI Key: NTAHMPNXQOYXSX-WKSONYIQSA-N
Can. SMILES: C/C=C\C=C\[C@H]1C(C)(C)[C@H]([C@H]([C@]([C@H](CC)C(=O)NC/C=C/C=C(\C)/[C@H]([C@@H](C)[C@H]2[C@H]([C@H]([C@@H](/C=C/C=C/C=C(\C)/C(=O)C3=C(C=CN(C)C3=O)O)O2)O)O)OC)(O)O1)O)O
InChI: InChI=1S/C44H62N2O12/c1-10-12-14-22-32-43(6,7)39(51)40(52)44(55,58-32)29(11-2)41(53)45-24-18-17-20-27(4)37(56-9)28(5)38-36(50)35(49)31(57-38)21-16-13-15-19-26(3)34(48)33-30(47)23-25-46(8)42(33)54/h10,12-23,25,28-29,31-32,35-40,47,49-52,55H,11,24H2,1-9H3,(H,45,53)/b12-10-,15-13+,18-17+,21-16+,22-14+,26-19+,27-20+/t28-,29-,31-,32+,35+,36+,37-,38+,39+,40-,44-/m1/s1
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/135509117
Citation: https://www.nature.com/articles/s41429-020-0344-z

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