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IUPAC Name: S-[2-[3-[[4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 3-oxopropanethioate | CAS Registry Number: 6244-93-5Synonyms: Malonyl-CoA semialdehyde, {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({[hydroxy(3-hydroxy-2,2-dimethyl-3-{[2-({2-[(3-oxopropanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy)phosphoryl]oxy})phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid, S-(3-oxopropanoate, Malonylsemialdehyde-CoA, S-(3-oxopropanoic acid, S-(3-oxopropanoate)CoA, 3-Oxopropionyl-coenzyme A, AC1L9A2V, Malonylsemialdehyde coenzyme A, Malonylsemialdehyde-Coenzyme A, S-(3-oxopropanoate)Coenzyme A, HMDB02170, LMFA07050347, NU008612, 1-Thiomalonaldehydic acid S-ester with coenzyme A, S-[2-[3-[[4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 3-oxopropanethioate
| Molecular Formula: | C24H38N7O18P3S | Molecular Weight: | 837.580 [g/mol] |
| H-Bond Donor: | 9 | H-Bond Acceptor: | 23 |
InChIKey: NMEYBPUHJHMRHU-UXYNFSPESA-N
