4-[2-(24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaen-23-yl)-2-nitroethyl]phenol
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![4-[2-(24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaen-23-yl)-2-nitroethyl]phenol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2990f5a713a74d6aa94f7d9853d4bba3.png "4-[2-(24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaen-23-yl)-2-nitroethyl]phenol")
4-[2-(24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaen-23-yl)-2-nitroethyl]phenol
structure -
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CAS No:
123787-75-7
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Formula:
C28H22N2O7
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Chemical Name:
4-[2-(24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaen-23-yl)-2-nitroethyl]phenol
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Synonyms:
123787-75-7;Nitrotyrasanguinarine;DTXSID90924600;4-[2-(13-Methyl-13,14-dihydro-2H,10H-[1,3]benzodioxolo[5,6-c][1,3]dioxolo[4,5-i]phenanthridin-14-yl)-2-nitroethyl]phenol
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CAS No:
4-[2-(24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaen-23-yl)-2-nitroethyl]phenol Basic Attributes
498.5 g/mol
498.14270105 g/mol
Computed Properties
Molecular Weight:498.5
XLogP3:5.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:498.14270105
Monoisotopic Mass:498.14270105
Topological Polar Surface Area:106
Heavy Atom Count:37
Complexity:847
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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