 Home > Encyclopedia > (3R,6S,9S)-3,6,9-tris[3-(hydroxyamino)propyl]-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone

(3R,6S,9S)-3,6,9-tris[3-(hydroxyamino)propyl]-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone

(3R,6S,9S)-3,6,9-tris[3-(hydroxyamino)propyl]-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone structure

CAS No:
347-58-0
Formula:
C21H39N9O9
Chemical Name:
(3R,6S,9S)-3,6,9-tris[3-(hydroxyamino)propyl]-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone
Synonyms:
347-58-0;DTXSID10956180;1,4,7,10,13,16-Hexaazacyclooctadecane-2,5,8,11,14,17-hexone, 3,6,9-tris(3-(hydroxyamino)propyl)-;3,6,9-Tris(3-(hydroxyamino)propyl)-1,4,7,10,13,16-hexaazacyclooctadecane-2,5,8,11,14,17-hexone;3,6,9-Tris[3-(hydroxyamino)propyl]-1,4,7,10,13,16-hexaazacyclooctadeca-1,4,7,10,13,16-hexaene-2,5,8,11,14,17-hexol

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(3R,6S,9S)-3,6,9-tris[3-(hydroxyamino)propyl]-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone Basic Attributes

Molecular Weight：

561.6 g/mol

Exact Mass：

561.28707386 g/mol

Characteristics

PSA：

271 Å²

Computed Properties

Molecular Weight:561.6
XLogP3:-4.4
Hydrogen Bond Donor Count:12
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:12
Exact Mass:561.28707386
Monoisotopic Mass:561.28707386
Topological Polar Surface Area:271
Heavy Atom Count:39
Complexity:831
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (3R,6S,9S)-3,6,9-tris[3-(hydroxyamino)propyl]-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone

Basic Attributes
Characteristics
Computed Properties

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