L-Phenylalaninamide,N-[(1,1-dimethylethoxy)carbonyl]glycyl-L-tryptophyl-L-methionyl-L-a-aspartyl-, phenylmethyl ester(9CI) (CAS 131449-37-1) — formula C45H55N7O10, molecular weight 854.0; category organic chemicals.
| CAS Number | 131449-37-1 |
|---|---|
| Molecular Formula | C45H55N7O10 |
| Molecular Weight | 854.0 |
| LogP | 1.6 |
| Category | Organic Chemicals |
L-Phenylalaninamide,N-[(1,1-dimethylethoxy)carbonyl]glycyl-L-tryptophyl-L-methionyl-L-a-aspartyl-, phenylmethyl ester(9CI) is a carbon-based organic compound with CAS registry number 131449-37-1 and molecular formula C45H55N7O10 (molecular weight 854.0), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 131449-37-1
Its molecular formula C45H55N7O10 comprises 45 C, 55 H, 7 N, 10 O atoms.
Also known as: L-Phenylalaninamide,N-[(1,1-dimethylethoxy)carbonyl]glycyl-L-tryptophyl-L-methionyl-L-a-aspartyl-, phenylmethyl ester(9CI) · L-苯丙氨酰胺，N-[(1,1-二甲基乙氧基)羰基]甘氨酰-L-色氨酸-L-甲硫氨酰-L-a-天冬氨酰-苯甲基酯(9CI)
Category: organic chemicals
The CAS registry number of L-Phenylalaninamide,N-[(1,1-dimethylethoxy)carbonyl]glycyl-L-tryptophyl-L-methionyl-L-a-aspartyl-, phenylmethyl ester(9CI) is 131449-37-1.
Molecular formula C45H55N7O10, molecular weight 854.0.
It is also registered under: L-Phenylalaninamide,N-[(1,1-dimethylethoxy)carbonyl]glycyl-L-tryptophyl-L-methionyl-L-a-aspartyl-, phenylmethyl ester(9CI), L-苯丙氨酰胺，N-[(1,1-二甲基乙氧基)羰基]甘氨酰-L-色氨酸-L-甲硫氨酰-L-a-天冬氨酰-苯甲基酯(9CI).
Category: Organic Chemicals.
Independent reference data for L-Phenylalaninamide,N-[(1,1-dimethylethoxy)carbonyl]glycyl-L-tryptophyl-L-methionyl-L-a-aspartyl-, phenylmethyl ester(9CI) (CAS 131449-37-1), compiled from public chemistry databases.
| CAS Registry Number | 131449-37-1 |
|---|---|
| PubChem CID | 6439313 |
| Molecular formula | C45H55N7O10 |
| IUPAC name | (3S)-3-[[(2S)-2-amino-6-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]hexanoyl]amino]-4-[[(2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]-[(2S)-2-(methylamino)-3-phenylpropanoyl]amino]-4-oxobutanoic acid |
| Molecular Weight | 854.0 |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 8 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 22 |
| Exact Mass | 853.40104098 |
| Monoisotopic Mass | 853.40104098 |
| Topological Polar Surface Area | 262 |
| Heavy Atom Count | 62 |
A 70874; A-70874; RefChem:108322; 131449-37-1; PDSP1_000878; PDSP2_000864; Boc-trp-lys(epsilon-N-4-hydroxycinnamoyl)-asp-(N-methyl)phe-NH2
L-Phenylalaninamide,N-[(1,1-dimethylethoxy)carbonyl]glycyl-L-tryptophyl-L-methionyl-L-a-aspartyl-, phenylmethyl ester(9CI) · CAS 131449-37-1 · C45H55N7O10.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: L-苯丙氨酰胺，N-[(1,1-二甲基乙氧基)羰基]甘氨酰-L-色氨酸-L-甲硫氨酰-L-a-天冬氨酰-苯甲基酯(9CI)