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Home > Encyclopedia > (2S)-2-amino-4-[(1S)-1-[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]-2-[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]ethyl]sulfanylbutanoic acid

(2S)-2-amino-4-[(1S)-1-[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]-2-[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]ethyl]sulfanylbutanoic acid

(2S)-2-amino-4-[(1S)-1-[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]-2-[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]ethyl]sulfanylbutanoic acid structure

(2S)-2-amino-4-[(1S)-1-[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]-2-[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]ethyl]sulfanylbutanoic acid 

structure
  • CAS No:

    101249-72-3

  • Formula:

    C15H25N6O14P3S

  • Chemical Name:

    (2S)-2-amino-4-[(1S)-1-[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]-2-[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]ethyl]sulfanylbutanoic acid

  • Synonyms:

    (5'-((N-triphosphoamino)methyl)adenosyl)homocysteine;(5'-((N-triphosphoamino)methyl)adenosyl)homocysteine, (5'S)-isomer;5-TPMAH;S-(5'(R)-((N-triphosphoamino)methyl)adenosyl)-L-homocysteine;5-Tpmah;101249-72-3;(5'-((N-Triphosphoamino)methyl)adenosyl)homocysteine;S-(5'(R)-((N-Triphosphoamino)methyl)adenosyl)-L-homocysteine

(2S)-2-amino-4-[(1S)-1-[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]-2-[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]ethyl]sulfanylbutanoic acid Basic Attributes

638.4 g/mol

638.03623166 g/mol

Characteristics

359 Ų

Drug Information

(5'-((N-triphosphoamino)methyl)adenosyl)homocysteine

Computed Properties

Molecular Weight:638.4
XLogP3:-7.5
Hydrogen Bond Donor Count:9
Hydrogen Bond Acceptor Count:20
Rotatable Bond Count:13
Exact Mass:638.03623166
Monoisotopic Mass:638.03623166
Topological Polar Surface Area:359
Heavy Atom Count:39
Complexity:1030
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of (2S)-2-amino-4-[(1S)-1-[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]-2-[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]ethyl]sulfanylbutanoic acid

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