3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-hydroxy-4,5,6,7-tetrahydroimidazo[4,5-e][1,4]diazepin-8-one
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![3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-hydroxy-4,5,6,7-tetrahydroimidazo[4,5-e][1,4]diazepin-8-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f9842ea1098e42b291ea78f33024f3ac.png "3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-hydroxy-4,5,6,7-tetrahydroimidazo[4,5-e][1,4]diazepin-8-one")
3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-hydroxy-4,5,6,7-tetrahydroimidazo[4,5-e][1,4]diazepin-8-one
structure -
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CAS No:
115173-45-0
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Formula:
C11H16N4O6
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Chemical Name:
3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-hydroxy-4,5,6,7-tetrahydroimidazo[4,5-e][1,4]diazepin-8-one
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Synonyms:
AZ-3-RI;azepinomycin 3-ribofuranoside;115173-45-0;Azepinomycin 3-ribofuranoside;AZ-3-RI;SCHEMBL10613605;DTXSID80921643;3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-hydroxy-4,5,6,7-tetrahydroimidazo[4,5-e][1,4]diazepin-8-one;3-Pentofuranosyl-3,4,5,6-tetrahydroimidazo[4,5-e][1,4]diazepine-6,8-diol;Imidazo(4,5-e)(1,4)diazepin-8(3H)-one, 4,5,6,7-tetrahydro-6-hydroxy-3-beta-D-ribofuranosyl-
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CAS No:
3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-hydroxy-4,5,6,7-tetrahydroimidazo[4,5-e][1,4]diazepin-8-one Basic Attributes
300.27 g/mol
300.10698424 g/mol
Computed Properties
Molecular Weight:300.27
XLogP3:-1.6
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:2
Exact Mass:300.10698424
Monoisotopic Mass:300.10698424
Topological Polar Surface Area:149
Heavy Atom Count:21
Complexity:412
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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