8-[[4-ethyl-3-[[2-ethyl-5-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid
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![8-[[4-ethyl-3-[[2-ethyl-5-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/400fb6ef0c4541368d6d9cba46c7d1b6.png "8-[[4-ethyl-3-[[2-ethyl-5-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid")
8-[[4-ethyl-3-[[2-ethyl-5-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid
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CAS No:
104869-33-2
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Formula:
C39H34N4O21S6
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Chemical Name:
8-[[4-ethyl-3-[[2-ethyl-5-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid
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Synonyms:
104869-33-2;CHEMBL1207462;DTXSID10332329;8-[[4-ethyl-3-[[2-ethyl-5-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid;1,3,5-Naphthalenetrisulfonic acid, 8,8'-[carbonylbis[imino(4-ethyl-3,1-phenylene)carbonylimino]]bis-;8-[[4-ethyl-3-[[2-ethyl-5-[(4,6,8-trisulfo-1-naphthyl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid
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CAS No:
8-[[4-ethyl-3-[[2-ethyl-5-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid Basic Attributes
1087.1 g/mol
1086.0039811 g/mol
DTXSID10332329
Computed Properties
Molecular Weight:1087.1
XLogP3:0.7
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:21
Rotatable Bond Count:14
Exact Mass:1086.0039811
Monoisotopic Mass:1086.0039811
Topological Polar Surface Area:476
Heavy Atom Count:70
Complexity:2460
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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