 Home > Encyclopedia > N-[3-[5,8-bis[3-[acetyl(oxido)amino]propyl]-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-N-oxidoacetamide;iron(3+)

N-[3-[5,8-bis[3-[acetyl(oxido)amino]propyl]-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-N-oxidoacetamide;iron(3+)

N-[3-[5,8-bis[3-[acetyl(oxido)amino]propyl]-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-N-oxidoacetamide;iron(3+) structure

CAS No:
11047-12-4
Formula:
C27H42FeN9O12
Chemical Name:
N-[3-[5,8-bis[3-[acetyl(oxido)amino]propyl]-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-N-oxidoacetamide;iron(3+)
Synonyms:
SCHEMBL41659;DTXSID50911697;Q1998031;11047-12-4;Iron(3+) {(3,6,9,12,15,18-hexahydroxy-1,4,7,10,13,16-hexaazacyclooctadeca-3,6,9,12,15,18-hexaene-2,5,8-triyl)tris[(propane-3,1-diyl)(acetylazanediyl)]}tris(oxidanide)

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N-[3-[5,8-bis[3-[acetyl(oxido)amino]propyl]-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-N-oxidoacetamide;iron(3+) Basic Attributes

Molecular Weight：

740.5 g/mol

Exact Mass：

740.230228 g/mol

Characteristics

PSA：

305 Å²

Computed Properties

Molecular Weight:740.5
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:12
Exact Mass:740.230228
Monoisotopic Mass:740.230228
Topological Polar Surface Area:305
Heavy Atom Count:49
Complexity:1200
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of N-[3-[5,8-bis[3-[acetyl(oxido)amino]propyl]-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-N-oxidoacetamide;iron(3+)

Basic Attributes
Characteristics
Computed Properties

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