D-erythro-2-Pentulose, 1-[(2-carboxyphenyl)amino]-1-deoxy-, 5-(dihydrogen phosphate)
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D-erythro-2-Pentulose, 1-[(2-carboxyphenyl)amino]-1-deoxy-, 5-(dihydrogen phosphate)
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CAS No:
5962-18-5
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Formula:
C12H16NO9P
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Chemical Name:
D-erythro-2-Pentulose, 1-[(2-carboxyphenyl)amino]-1-deoxy-, 5-(dihydrogen phosphate)
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Synonyms:
D-erythro-2-Pentulose,1-[(2-carboxyphenyl)amino]-1-deoxy-,5-(dihydrogen phosphate);D-erythro-Pentulose,1-(o-carboxyanilino)-1-deoxy-,5-(dihydrogen phosphate);D-erythro-Pentulose,1-(o-carboxyanilino)-1-deoxy-,5-phosphate;Anthranilic deoxyribulotide;24553-99-9
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CAS No:
Description
ChEBI: A deoxyribulose phosphate that is D-ribulose 5-phosphate in which the hydroxy group at position 1 is replaced by a 2-carboxyphenylamino group.
1-(2-carboxyphenylamino)-1-deoxy-D-ribulose 5-phosphate is a deoxyribulose phosphate that is D-ribulose 5-phosphate in which the hydroxy group at position 1 is replaced by a 2-carboxyphenylamino group. It has a role as an Escherichia coli metabolite. It derives from a D-ribulose and an anthranilic acid. It is a conjugate acid of a 1-(2-carboxylatophenylamino)-1-deoxy-D-ribulose 5-phosphate(3-).
D-erythro-2-Pentulose, 1-[(2-carboxyphenyl)amino]-1-deoxy-, 5-(dihydrogen phosphate) Basic Attributes
349.232
349.23
Computed Properties
Molecular Weight:349.23
XLogP3:-1.3
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:9
Exact Mass:349.05626809
Monoisotopic Mass:349.05626809
Topological Polar Surface Area:174
Heavy Atom Count:23
Complexity:465
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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D-erythro-2-Pentulose, 1-[(2-carboxyphenyl)amino]-1-deoxy-, 5-(dihydrogen phosphate)
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