Identification
Name |
Paldimycin A |
Synonyms |
(5S)-5-[(2R,3R,4S,5R,6R)-5-[3-[(2R)-2-Acetamido-3-Hydroxy-3-Oxo-Propyl]Sulfanyl-2-[[(2R)-2-Acetamido-3-Hydroxy-3-Oxo-Propyl]Sulfanylcarbothioylamino]Butanoyl]Oxy-6-(Acetoxymethyl)-3-Hydroxy-4-[(4S,5S,6S)-5-Hydroxy-4-Methoxy-6-Methyl-5-[(1S)-1-[(2S)-2-Meth |
|
Molecular Structure |
 |
Molecular Formula |
C44H64N4O23S3 |
Molecular Weight |
1113.18 |
CAS Registry Number |
94555-00-7 |
SMILES |
[C@]3(O)([C@@H]2O[C@@H]([C@@H](OC(=O)C(NC(SC[C@H](NC(=O)C)C(=O)O)=S)C(SC[C@H](NC(=O)C)C(=O)O)C)[C@@H](OC1O[C@H]([C@](O)([C@@H](OC(=O)[C@H](CC)C)C)[C@@H](OC)C1)C)[C@H]2O)COC(=O)C)C(=O)C(=C(N)C(=O)C3)C(=O)O |
InChI |
1S/C44H64N4O23S3/c1-10-16(2)40(61)68-19(5)44(64)18(4)67-28(11-27(44)65-9)70-34-32(53)36(43(63)12-25(52)30(45)29(35(43)54)39(59)60)69-26(13-66-22(8)51)33(34)71-41(62)31(17(3)73-14-23(37(55)56)46-20(6)49)48-42(72)74-15-24(38(57)58)47-21(7)50/h16-19,23-24,26 |
InChIKey |
UZGZVADYRITDOQ-OWVLXQSESA-N |
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