![[hydroxy(phenyl)methyl]succinyl-CoA structure](/static/products/138/1383686-26-7.webp)
[hydroxy(phenyl)methyl]succinyl-CoA
TL;DR: [hydroxy(phenyl)methyl]succinyl-CoA (CAS 1383686-26-7) is a chemical compound with molecular formula C32H46N7O20P3S and molecular weight 973.1731 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-[3-[[(2R)-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]ethylsulfanylcarbonyl]-4-hydroxy-4-phenylbutanoic acid
Also Known As: [hydroxy(phenyl)methyl]succinyl-CoA|(Hydroxymethylphenyl)succinyl-CoA|2-(alpha-hydroxybenzyl)succinyl-CoA|[hydroxy(phenyl)methyl]succinyl-coenzyme A|2-(alpha-hydroxybenzyl)succinyl-coenzyme A|2-Carboxymethyl-3-hydroxy-phenylpropionyl CoA|J1.220.691G|(Hydroxymethylphenyl)succinyl-CoA; (Acyl-CoA); [M+H]+;|S-[2-(alpha-Hydroxybenzyl)-4-hydroxy-4-oxobutyryl]coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[2-(carboxymethyl)-3-hydroxy-3-phenylpropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-[2-[3-[[(2R)-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]ethylsulfanylcarbonyl]-4-hydroxy-4-phenylbutanoic acid|3-{[(2-{3-[(2R)-3-[({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)methyl]-2-hydroxy-3-methylbutanamido]propanamido}ethyl)sulfanyl]carbonyl}-4-hydroxy-4-phenylbutanoic acid|orb3145201|TYD-04546
Technical Specifications
| Molecular Formula | C32H46N7O20P3S |
| Molecular Weight | 973.1731 g/mol |
| XLogP | -5.3 |
| Topological Polar Surface Area (TPSA) | 446.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 25 |
| Rotatable Bonds | 25 |
| Exact Mass | 973.1731 Da |
| Heavy Atoms | 63 |
| Complexity | 1730.0 |
| SMILES | CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)C(CC(=O)O)C(C4=CC=CC=C4)O)O |
| InChIKey | DVSQFPLMOLPRDU-ONDZYRKQSA-N |
Chemical Property Profile of [hydroxy(phenyl)methyl]succinyl-CoA
Property Insights of [hydroxy(phenyl)methyl]succinyl-CoA
The XLogP value of -5.3 indicates that [hydroxy(phenyl)methyl]succinyl-CoA is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 446.0 Ų indicates high polarity, suggesting [hydroxy(phenyl)methyl]succinyl-CoA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [hydroxy(phenyl)methyl]succinyl-CoA has 11 hydrogen bond donor(s) and 25 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of [hydroxy(phenyl)methyl]succinyl-CoA?
The CAS number of [hydroxy(phenyl)methyl]succinyl-CoA is 1383686-26-7.
What is the molecular formula of [hydroxy(phenyl)methyl]succinyl-CoA?
The molecular formula of [hydroxy(phenyl)methyl]succinyl-CoA is C32H46N7O20P3S.
What is the molecular weight of [hydroxy(phenyl)methyl]succinyl-CoA?
The molecular weight of [hydroxy(phenyl)methyl]succinyl-CoA is 973.1731 g/mol.
Where can I buy [hydroxy(phenyl)methyl]succinyl-CoA?
You can request a quote for [hydroxy(phenyl)methyl]succinyl-CoA directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [hydroxy(phenyl)methyl]succinyl-CoA?
Yes, CoreyChem provides custom synthesis services for [hydroxy(phenyl)methyl]succinyl-CoA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.