L-Valine, L-threonyl-D-valyl-L-prolyl-N-methylglycyl-N-methyl-, ξ-lactone, 1,1'-diamide with 3-ethyl-10,12-dimethyl-2-oxo-2H,6H-1,4-oxazino[3,2-b]phenoxazine-5,7-dicarboxylic acid (9CI)
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![L-Valine, L-threonyl-D-valyl-L-prolyl-N-methylglycyl-N-methyl-, ξ-lactone, 1,1'-diamide with 3-ethyl-10,12-dimethyl-2-oxo-2H,6H-1,4-oxazino[3,2-b]phenoxazine-5,7-dicarboxylic acid (9CI) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/48b7d4b1458b42c785ef746da6a03810.png "L-Valine, L-threonyl-D-valyl-L-prolyl-N-methylglycyl-N-methyl-, ξ-lactone, 1,1'-diamide with 3-ethyl-10,12-dimethyl-2-oxo-2H,6H-1,4-oxazino[3,2-b]phenoxazine-5,7-dicarboxylic acid (9CI)")
L-Valine, L-threonyl-D-valyl-L-prolyl-N-methylglycyl-N-methyl-, ξ-lactone, 1,1'-diamide with 3-ethyl-10,12-dimethyl-2-oxo-2H,6H-1,4-oxazino[3,2-b]phenoxazine-5,7-dicarboxylic acid (9CI)
structure -
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CAS No:
70789-46-7
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Formula:
C66H90N12O17
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Chemical Name:
L-Valine, L-threonyl-D-valyl-L-prolyl-N-methylglycyl-N-methyl-, ξ-lactone, 1,1'-diamide with 3-ethyl-10,12-dimethyl-2-oxo-2H,6H-1,4-oxazino[3,2-b]phenoxazine-5,7-dicarboxylic acid (9CI)
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Synonyms:
3,10-dihydroactinomycin D3-ethyloxazinone;
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CAS No:
L-Valine, L-threonyl-D-valyl-L-prolyl-N-methylglycyl-N-methyl-, ξ-lactone, 1,1'-diamide with 3-ethyl-10,12-dimethyl-2-oxo-2H,6H-1,4-oxazino[3,2-b]phenoxazine-5,7-dicarboxylic acid (9CI) Basic Attributes
1323.49000
1322.65468945 g/mol
Computed Properties
Molecular Weight:1323.5
XLogP3:4.9
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:19
Rotatable Bond Count:9
Exact Mass:1322.65468945
Monoisotopic Mass:1322.65468945
Topological Polar Surface Area:351
Heavy Atom Count:95
Complexity:3030
Undefined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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