(2S)-2-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]pentanedioic acid (CAS 33611-85-7) — formula C39H47N11O18, molecular weight 957.9; category organic chemicals.
| CAS Number | 33611-85-7 |
|---|---|
| Molecular Formula | C39H47N11O18 |
| Molecular Weight | 957.9 |
| LogP | -4.1 |
| Category | Organic Chemicals |
(2S)-2-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]pentanedioic acid is a carbon-based organic compound with CAS registry number 33611-85-7 and molecular formula C39H47N11O18 (molecular weight 957.9), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 33611-85-7
Its molecular formula C39H47N11O18 comprises 39 C, 47 H, 11 N, 18 O atoms.
Also known as: (2S)-2-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]pentanedioic acid · (2S)-2-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[4-[(2-氨基-4-氧代-1H-蝶啶-6-基)甲基氨基]苯甲酰基]氨基]-4-ca [羧基-丁酰基]氨基]-4-羧基-丁酰基]氨基]-4-羧基-丁酰基]氨基]-4-羧基-丁酰基]氨基]戊二酸酸
Category: organic chemicals
The CAS registry number of (2S)-2-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]pentanedioic acid is 33611-85-7.
Molecular formula C39H47N11O18, molecular weight 957.9.
It is also registered under: (2S)-2-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]pentanedioic acid, (2S)-2-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[4-[(2-氨基-4-氧代-1H-蝶啶-6-基)甲基氨基]苯甲酰基]氨基]-4-ca [羧基-丁酰基]氨基]-4-羧基-丁酰基]氨基]-4-羧基-丁酰基]氨基]-4-羧基-丁酰基]氨基]戊二酸酸.
Category: Organic Chemicals.
Independent reference data for (2S)-2-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]pentanedioic acid (CAS 33611-85-7), compiled from public chemistry databases.
| CAS 号 | 33611-85-7 |
|---|---|
| PubChem CID | 135406300 |
| 分子式 | C39H47N11O18 |
| IUPAC 名称 | 2-[[4-[[4-[[4-[[4-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]pentanedioic acid |
| Molecular Weight | 957.9 |
|---|---|
| XLogP3 | -4.1 |
| Hydrogen Bond Donor Count | 14 |
| Hydrogen Bond Acceptor Count | 22 |
| Rotatable Bond Count | 29 |
| Exact Mass | 957.31005369 |
| Monoisotopic Mass | 957.31005369 |
| Topological Polar Surface Area | 475 |
| Heavy Atom Count | 68 |
NSC372667; DTXSID60331140; NSC-372667; 25663-26-7
(2S)-2-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[(4S)-4-[[4-[(2-氨基-4-氧代-1H-蝶啶-6-基)甲基氨基]苯甲酰基]氨基]-4-ca [羧基-丁酰基]氨基]-4-羧基-丁酰基]氨基]-4-羧基-丁酰基]氨基]-4-羧基-丁酰基]氨基]戊二酸酸 · CAS 33611-85-7 · C39H47N11O18.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.