Basic information
- CAS
73554-93-5- Standard SMILES
Cc1cc(=O)oc2cc(N[C@@H](CCCN=C(N)N)C(=O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H](C)O)ccc12- InChIKey
KHROACPEOHQTRJ-ZDLOCFOUSA-N- Molecular formula
- C34H52N8O10
- Average molar mass
- 732.8 g/mol
- Monoisotopic mass
- 732.38063989
Overview
fluorogenic peptide substrate for protein C measurement
Names & identifiers
- Preferred name
- Boc-leucyl-seryl-threonyl-arginine-4-methylcoumaryl-7-amide
- IUPAC
- tert-butyl N-[(2S)-1-[[(2S)-1-[[(2S,3R)-1-[[(2S)-5-(diaminomethylideneamino)-2-[(4-methyl-2-oxochromen-7-yl)amino]pentanoyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate
- English name
- BOC-LEU-SER-THR-ARG-MCA
- Molecular formula
- C34H52N8O10
- Molecular weight
- 732.83
Names & synonyms
Boc-leucyl-seryl-threonyl-arginine-4-methylcoumaryl-7-amideL-Argininamide, N-((1,1-dimethylethoxy)carbonyl)-L-leucyl-L-seryl-L-threonyl-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-RefChem:12084173554-93-5Boc-leu-ser-thr-arg-mcatert-butyl N-[(2S)-1-[[(2S)-1-[[(2S,3R)-1-[[(2S)-5-(diaminomethylideneamino)-2-[(4-methyl-2-oxochromen-7-yl)amino]pentanoyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamateSCHEMBL29511613DTXSID2091471195991-89-2(2S)-2-{[tert-Butoxy(hydroxy)methylidene]amino}-N-[(2S)-1-{[(2S,3R)-1-({(2S)-5-(carbamimidoylamino)-1-hydroxy-2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)amino]pentylidene}amino)-3-hydroxy-1-oxobutan-2-yl]imino}-1,3-dihydroxypropan-2-yl]-4-methylpentanimidic acid2-{[tert-Butoxy(hydroxy)methylidene]amino}-N-(1-{[1-({5-carbamimidamido-1-hydroxy-2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)amino]pentylidene}amino)-3-hydroxy-1-oxobutan-2-yl]imino}-1,3-dihydroxypropan-2-yl)-4-methylpentanimidic acidBoc-LSTR-AMC
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 286 Ų
- Hydrogen bond donors
- 9
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 19
- Heavy atoms
- 52
- Formal charge
- 0
- Complexity
- 1,340
Physicochemical properties
- Density
- 1.37 · 1.37±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C
- solubility
- 2 mg/mL, · ethanol: 2mg/mL, clear, colorless
- pka
- 11.32 · 11.32±0.46(Predicted)
- form
- powder
- Sequence
- Boc-Leu-Ser-Thr-Arg-AMC
- InChIKey
- ZJNWKMRGENOMCV-UHFFFAOYSA-N
- SMILES
- CC(C)CC(NC(=O)OC(C)(C)C)C(=O)NC(CO)C(=O)NC(C(C)O)C(=O)NC(CCCNC(N)=N)C(=O)Nc1ccc2C(C)=CC(=O)Oc2c1
- UNSPSC Code
- 12352204 · 12352204
- NACRES
- 32 · NA.32
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
- WGK Germany
- 3 · 3
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Applications
UsesBoc-Leu-Ser-Thr-Arg-AMC is a fluorogenic AMC-linked protease substrate[1].
Suppliers33 total
成都彼样生物科技有限公司18108052721 · [email protected]
上海优宁维生物科技股份有限公司15921930842 15921930842 · [email protected]
南京昱盛康生物科技有限公司13327808530 · [email protected]
上海鸿肽生物科技有限公司15318089928 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
中科华药(江苏)生物科技有限公司18020125070 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
杭州思诺达医药科技有限责任公司0571-87213919 17306812703 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
Zhejiang J&C Biological Technology Co.,Limited+1-2135480471 · [email protected]
Chengdu Youngshe Chemical Co., Ltd.+86-18108235634 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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