Coenzyme A, S-(4-hydroxybenzoate)
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Coenzyme A, S-(4-hydroxybenzoate)
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CAS No:
27718-41-8
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Formula:
C28H40N7O18P3S
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Chemical Name:
Coenzyme A, S-(4-hydroxybenzoate)
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Synonyms:
Coenzyme A,S-(4-hydroxybenzoate);Coenzyme A,S-(p-hydroxybenzoate);Benzoic acid,p-hydroxythio-,S-ester with coenzyme A;(p-Hydroxybenzoyl)-coenzyme A;(4-Hydroxybenzoyl)-coenzyme A;(4-Hydroxybenzoyl)-CoA;27718-63-4
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CAS No:
Description
4-hydroxybenzoyl-CoA is a hydroxybenzoyl-CoA that is the S-(4-hydroxybenzoyl) derivative of coenzyme A. It derives from a benzoyl-CoA and a 4-hydroxybenzoic acid. It is a conjugate acid of a 4-hydroxybenzoyl-CoA(4-).
Computed Properties
Molecular Weight:887.6
XLogP3:-4.3
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:23
Rotatable Bond Count:21
Exact Mass:887.13633962
Monoisotopic Mass:887.13633962
Topological Polar Surface Area:409
Heavy Atom Count:57
Complexity:1540
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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