1-methyl N-[N-[N-[N-[(tert-butoxy)carbonyl]-L-tryptophyl]-L-methionyl]-L-alpha-aspartyl]-3-phenyl-L-alaninate (CAS 5262-09-9) — formula C35H45N5O9S, molecular weight 711.8; category organic chemicals.
| CAS Number | 5262-09-9 |
|---|---|
| Molecular Formula | C35H45N5O9S |
| Molecular Weight | 711.8 |
| LogP | 3.6 |
| Category | Organic Chemicals |
1-methyl N-[N-[N-[N-[(tert-butoxy)carbonyl]-L-tryptophyl]-L-methionyl]-L-alpha-aspartyl]-3-phenyl-L-alaninate is a carbon-based organic compound with CAS registry number 5262-09-9 and molecular formula C35H45N5O9S (molecular weight 711.8), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5262-09-9
Its molecular formula C35H45N5O9S comprises 35 C, 45 H, 5 N, 9 O, 1 S atoms.
Also known as: 1-methyl N-[N-[N-[N-[(tert-butoxy)carbonyl]-L-tryptophyl]-L-methionyl]-L-alpha-aspartyl]-3-phenyl-L-alaninate · N-[N-[N-[N-[(叔丁氧基)羰基]-L-色氨酸]-L-甲硫氨酰]-L-α-天冬氨酰]-3-苯基-L-丙氨酸1-甲基
Category: organic chemicals
The CAS registry number of 1-methyl N-[N-[N-[N-[(tert-butoxy)carbonyl]-L-tryptophyl]-L-methionyl]-L-alpha-aspartyl]-3-phenyl-L-alaninate is 5262-09-9.
Molecular formula C35H45N5O9S, molecular weight 711.8.
It is also registered under: 1-methyl N-[N-[N-[N-[(tert-butoxy)carbonyl]-L-tryptophyl]-L-methionyl]-L-alpha-aspartyl]-3-phenyl-L-alaninate, N-[N-[N-[N-[(叔丁氧基)羰基]-L-色氨酸]-L-甲硫氨酰]-L-α-天冬氨酰]-3-苯基-L-丙氨酸1-甲基.
Category: Organic Chemicals.
Independent reference data for 1-methyl N-[N-[N-[N-[(tert-butoxy)carbonyl]-L-tryptophyl]-L-methionyl]-L-alpha-aspartyl]-3-phenyl-L-alaninate (CAS 5262-09-9), compiled from public chemistry databases.
| CAS 号 | 5262-09-9 |
|---|---|
| PubChem CID | 111053 |
| 分子式 | C35H45N5O9S |
| IUPAC 名称 | (3S)-3-[[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-[[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid |
| UNII（FDA） | NS00044818 |
| Molecular Weight | 711.8 |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 20 |
| Exact Mass | 711.29379920 |
| Monoisotopic Mass | 711.29379920 |
| Topological Polar Surface Area | 230 |
| Heavy Atom Count | 50 |
5262-09-9; EINECS 226-074-6; DTXSID90967057; 1-Methyl N-(N-(N-(N-((tert-butoxy)carbonyl)-L-tryptophyl)-L-methionyl)-L-alpha-aspartyl)-3-phenyl-L-alaninate; NS00044818
N-[N-[N-[N-[(叔丁氧基)羰基]-L-色氨酸]-L-甲硫氨酰]-L-α-天冬氨酰]-3-苯基-L-丙氨酸1-甲基 · CAS 5262-09-9 · C35H45N5O9S. UNII NS00044818.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: N-[N-[N-[N-[(叔丁氧基)羰基]-L-色氨酸]-L-甲硫氨酰]-L-α-天冬氨酰]-3-苯基-L-丙氨酸1-甲基