4-Methyl-2-oxopentanoic acid--arginine (1/1)

HCID 337023

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Basic information

CAS: 72087-40-2
Standard SMILES: CC(C)CC(=O)C(=O)O.NC(N)=NCCCC(N)C(=O)O
InChIKey: MOZIGXHKOXEDLJ-UHFFFAOYSA-N
Molecular formula: C12H24N4O5
Average molar mass: 304.34 g/mol
Monoisotopic mass: 304.17466988

Names & identifiers

Preferred name: 4-Methyl-2-oxopentanoic acid--arginine (1/1)
IUPAC: 2-amino-5-(diaminomethylideneamino)pentanoic acid;4-methyl-2-oxopentanoic acid
English name: L-arginine mono(4-methyl-2-oxovalerate)
Molecular formula: C12H24N4O5
Molecular weight: 304.35

Names & synonyms

NSC353624(2S)-2-amino-5-carbamimidamidopentanoic acid; 4-methyl-2-oxopentanoic acidDTXSID909928094-Methyl-2-oxopentanoic acid--arginine (1/1)2-amino-5-(diaminomethylideneamino)pentanoic acid,4-methyl-2-oxopentanoic acidKIC-arginineL-ArginineKICL-Argininel KICarginine alpha-ketoisocaproateL-arginine mono(4-methyl-2-oxovalerate)2-amino-5-(diaminomethylideneamino)pentanoicacid,4-methyl-2-oxopentanoicaci

Database identifiers

CAS: 72087-40-2
PubChem CID: 337023
DTXSID: DTXSID90992809

Properties

Computed structural properties

Topological polar surface area: 182 Å²
Hydrogen bond donors: 5
Hydrogen bond acceptors: 7
Rotatable bonds: 8
Heavy atoms: 21
Formal charge: 0
Complexity: 303

Physicochemical properties

FDA UNII: 7 S4R4V1RM7 · 7S4R4V1RM7

Chemistry & industry

Suppliers12 total

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]

Xunteng International Trading Co.,Limited—

北京环宇世纪化学科技有限公司hysj_bj.com

上海孚一生物科技有限公司+86 (21) 61124340

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