N2-[N2-(3-Hydroxy-8-methyl-1-oxodecyl)-D-DAB-]cyclo[L-DAB*-L-DAB-D-Leu-L-Leu-L-DAB-L-DAB-L-Leu-] (CAS 50935-39-2) — formula C52H91N13O10, molecular weight 1058.4; category organic chemicals.
| CAS Number | 50935-39-2 |
|---|---|
| Molecular Formula | C52H91N13O10 |
| Molecular Weight | 1058.4 |
| LogP | 0.7 |
| Category | Organic Chemicals |
N2-[N2-(3-Hydroxy-8-methyl-1-oxodecyl)-D-DAB-]cyclo[L-DAB*-L-DAB-D-Leu-L-Leu-L-DAB-L-DAB-L-Leu-] is a carbon-based organic compound with CAS registry number 50935-39-2 and molecular formula C52H91N13O10 (molecular weight 1058.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 50935-39-2
Its molecular formula C52H91N13O10 comprises 52 C, 91 H, 13 N, 10 O atoms.
Also known as: N2-[N2-(3-Hydroxy-8-methyl-1-oxodecyl)-D-DAB-]cyclo[L-DAB*-L-DAB-D-Leu-L-Leu-L-DAB-L-DAB-L-Leu-] · N2-[N2-(3-羟基-8-甲基-1-氧代癸基)-D-DAB-]环[L-DAB*-L-DAB-D-Leu-L-Leu-L-DAB-L-DAB-L-Leu-]
Category: organic chemicals
The CAS registry number of N2-[N2-(3-Hydroxy-8-methyl-1-oxodecyl)-D-DAB-]cyclo[L-DAB*-L-DAB-D-Leu-L-Leu-L-DAB-L-DAB-L-Leu-] is 50935-39-2.
Molecular formula C52H91N13O10, molecular weight 1058.4.
It is also registered under: N2-[N2-(3-Hydroxy-8-methyl-1-oxodecyl)-D-DAB-]cyclo[L-DAB*-L-DAB-D-Leu-L-Leu-L-DAB-L-DAB-L-Leu-], N2-[N2-(3-羟基-8-甲基-1-氧代癸基)-D-DAB-]环[L-DAB*-L-DAB-D-Leu-L-Leu-L-DAB-L-DAB-L-Leu-].
Category: Organic Chemicals.
Independent reference data for N2-[N2-(3-Hydroxy-8-methyl-1-oxodecyl)-D-DAB-]cyclo[L-DAB*-L-DAB-D-Leu-L-Leu-L-DAB-L-DAB-L-Leu-] (CAS 50935-39-2), compiled from public chemistry databases.
| CAS 号 | 50935-39-2 |
|---|---|
| PubChem CID | 46883548 |
| 分子式 | C52H91N13O10 |
| IUPAC 名称 | N-[(2S)-4-amino-1-oxo-1-[[(3S,6S,9S,12S,15R,18S,21S)-6,9,18-tris(2-aminoethyl)-15-benzyl-3,12-bis(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptazacyclotricos-21-yl]amino]butan-2-yl]-3-hydroxy-9-methyldecanamide |
| Molecular Weight | 1058.4 |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 14 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 25 |
| Exact Mass | 1057.70118615 |
| Monoisotopic Mass | 1057.70118615 |
| Topological Polar Surface Area | 386 |
| Heavy Atom Count | 75 |
Octapeptin A1; RefChem:928117; 50935-39-2; CHEMBL1089243; SCHEMBL31084524
N2-[N2-(3-羟基-8-甲基-1-氧代癸基)-D-DAB-]环[L-DAB*-L-DAB-D-Leu-L-Leu-L-DAB-L-DAB-L-Leu-] · CAS 50935-39-2 · C52H91N13O10.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: N2-[N2-(3-羟基-8-甲基-1-氧代癸基)-D-DAB-]环[L-DAB*-L-DAB-D-Leu-L-Leu-L-DAB-L-DAB-L-Leu-]