N-[4,17-dimethyl-3,6,10,13,16,19,23,26-octaoxo-11,24-dipropyl-20-(quinoxaline-2-carbonylamino)-9,22-dioxa-28,29-dithia-2,5,12,15,18,25-hexazabicyclo[12.12.4]triacontan-7-yl]quinoxaline-2-carboxamide
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N-[4,17-dimethyl-3,6,10,13,16,19,23,26-octaoxo-11,24-dipropyl-20-(quinoxaline-2-carbonylamino)-9,22-dioxa-28,29-dithia-2,5,12,15,18,25-hexazabicyclo[12.12.4]triacontan-7-yl]quinoxaline-2-carboxamide
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CAS No:
63478-55-7
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Formula:
C46H54N12O12S2
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Chemical Name:
N-[4,17-dimethyl-3,6,10,13,16,19,23,26-octaoxo-11,24-dipropyl-20-(quinoxaline-2-carbonylamino)-9,22-dioxa-28,29-dithia-2,5,12,15,18,25-hexazabicyclo[12.12.4]triacontan-7-yl]quinoxaline-2-carboxamide
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Synonyms:
des-N-tetramethyltriostin A;TANDEM (quinoxaline);TANDEM (quinoxaline);Des-N-tetramethyltriostin A;L-Valine, N-(2-quinoxalinylcarbonyl)-D-seryl-L-alanyl-L-cysteinyl-, bimol. (4-1'),(4'-1)-dilactone, cyclic (3-3')-disulfide;L-Valine, N-(2-quinoxalinylcarbonyl)-D-seryl-L-alanyl-L-cysteinyl-, bimol. lactone, cyclic disulfide
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CAS No:
N-[4,17-dimethyl-3,6,10,13,16,19,23,26-octaoxo-11,24-dipropyl-20-(quinoxaline-2-carbonylamino)-9,22-dioxa-28,29-dithia-2,5,12,15,18,25-hexazabicyclo[12.12.4]triacontan-7-yl]quinoxaline-2-carboxamide Basic Attributes
1031.1 g/mol
1030.34255755 g/mol
Computed Properties
Molecular Weight:1031.1
XLogP3:1.1
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:8
Exact Mass:1030.34255755
Monoisotopic Mass:1030.34255755
Topological Polar Surface Area:388
Heavy Atom Count:72
Complexity:1850
Undefined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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