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CAS No.: | 102636-82-8 |
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Name: | Glutaroyl carnitine |
Molecular Structure: | |
Formula: | C12H21NO6 |
Molecular Weight: | 275.2982 |
Synonyms: | 1-Propanaminium,3-carboxy-2-(4-carboxy-1-oxobutoxy)-N,N,N-trimethyl-, inner salt, (R)-;Glutarylcarnitine;1-Propanaminium,3-carboxy-2-(4-carboxy-1-oxobutoxy)-N,N,N-trimethyl-, inner salt, (2R)-; |
PSA: | 103.73000 |
LogP: | -1.00070 |
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Product Name: Glutaroyl carnitine
Synonyms of Glutaroyl carnitine (CAS NO.102636-82-8): Glutaroyl N-(methyl-D3)-carnitine
CAS NO: 102636-82-8
Molecular Formula of Glutaroyl carnitine (CAS NO.102636-82-8): C12H21NO6
Molecular Weight: 275.2982
Molecular Structure:
H bond acceptors: 7
H bond donors: 2
Freely Rotating Bonds: 10
Polar Surface Area of Glutaroyl carnitine (CAS NO.102636-82-8): 103.73 Å2
SMILES: C[N+](C)(C)CC(OC(=O)CCCC(O)=O)CC([O-])=O
InChI: InChI=1/C12H21NO6/c1-13(2,3)8-9(7-11(16)17)19-12(18)6-4-5-10(14)15/h9H,4-8H2,1-3H3,(H-,14,15,16,17) InChIKey: NXJAXUYOQLTISD-UHFFFAOYAA
Std. InChI: InChI=1S/C12H21NO6/c1-13(2,3)8-9(7-11(16)17)19-12(18)6-4-5-10(14)15/h9H,4-8H2,1-3H3,(H-,14,15,16,17)
Std. InChIKey: NXJAXUYOQLTISD-UHFFFAOYSA-N