Cas no 143113-45-5 (BQ-3020)
BQ-3020 structure
Product Name:BQ-3020
CAS No:143113-45-5
MF:C96H140N20O25S
MW:2006.3228225708
CID:212442
Update Time:2024-11-04
BQ-3020 Chemical and Physical Properties
Names and Identifiers
-
- 6-21-Endothelin1 (swine reduced), N-acetyl-11-L-alanine-15-L-alanine-
- Acetyl-(Ala??·??)-Endothelin-1(6-21)
- ACETYL-(ALA11·15)-ENDOTHELIN-1 (6-21)
- Acetyl-(Ala11·15)-Endothelin-1 (6-21), BQ-3020
- BQ-3020
- Acetyl-(Ala 11,15)-ET 1 (6-21)
- N-Acetyl-[Ala11,15]-Endothelin 1 fragment 6-21
- Acetyl-[Ala 11,15]-endothelin 1 (6-21)
- BQ 3020
- endothelin receptor antagonist
- N-AC, ALA11,15-ENDOTHELIN 1, 6-21
- N-ACETYL[ALA11,15]-ENDOTHELIN-1 (6-21)
- N-ACETYL-[ALA11,15]ENDOTHELIN-I (6-21)
- AC-(ALA11,15)-ENDOTHELIN-1 (6-21)
- ENDOTHELIN-1(6-21), N-ACETYL-[ALA11,15]-
- Acetyl-(Ala11·15)-Endothelin-1 (6-21) Ac-Leu-Met-Asp-Lys-Glu-Ala-Val-Tyr-Phe-Ala-His-Leu-Asp-Ile-Ile-Trp-OH
- ACETYL-(ALA11,15)-ENDOTHELIN-1 (6-21)
-
- Inchi： 1S/C96H140N20O25S/c1-15-52(9)79(94(138)113-74(96(140)141)42-59-46-99-63-27-21-20-26-62(59)63)116-95(139)80(53(10)16-2)115-92(136)73(45-77(123)124)111-88(132)68(39-50(5)6)108-90(134)71(43-60-47-98-48-100-60)107-81(125)54(11)102-86(130)69(40-57-24-18-17-19-25-57)109-89(133)70(41-58-29-31-61(118)32-30-58)112-93(137)78(51(7)8)114-82(126)55(12)101-83(127)65(33-34-75(119)120)105-84(128)64(28-22-23-36-97)104-91(135)72(44-76(121)122)110-85(129)66(35-37-142-14)106-87(131)67(38-49(3)4)103-56(13)117/h17-21,24-27,29-32,46-55,64-74,78-80,99,118H,15-16,22-23,28,33-45,97H2,1-14H3,(H,98,100)(H,101,127)(H,102,130)(H,103,117)(H,104,135)(H,105,128)(H,106,131)(H,107,125)(H,108,134)(H,109,133)(H,110,129)(H,111,132)(H,112,137)(H,113,138)(H,114,126)(H,115,136)(H,116,139)(H,119,120)(H,121,122)(H,123,124)(H,140,141)/t52-,53-,54-,55-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,78-,79-,80-/m0/s1
- InChI Key： AYJUXFCWNAVJLN-FHOIYVHLSA-N
- SMILES： C12C=CC=CC=1NC=C2C[C@@H](C(=O)O)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC1C=CC=CC=1)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)C)CC(C)C)CC1C=CC(O)=CC=1)CC1N=CNC=1
Computed Properties
- Exact Mass: 2005.00000
- Monoisotopic Mass: 1932.980791
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 24
- Hydrogen Bond Acceptor Count: 45
- Heavy Atom Count: 142
- Rotatable Bond Count: 79
- Complexity: 4020
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 17
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 694
- Surface Charge: 0
- Tautomer Count: 1000
- XLogP3: 2.3
Experimental Properties
- Color/Form: White powder
- Density: 1.287±0.06 g/cm3 (20 oC 760 Torr),
- Boiling Point: 2125.8±65.0 °C(Predicted)
- Solubility: Extremely soluble (1000 g/l) (25 o C),
- PSA: 730.82000
- LogP: 7.25970
- pka: 3.39±0.10(Predicted)
- Solubility: Not determined
- Sensitiveness: Light Sensitive
BQ-3020 Security Information
- Hazardous Material transportation number：NONH for all modes of transport
- WGK Germany：3
- Storage Condition：?20°C
BQ-3020 Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| AAPPTec | P001379-1mg |
Ac-[Ala11,15]-Endothelin 1 (6-21) |
143113-45-5 | 1mg |
$125.00 | 2024-07-20 | ||
| AAPPTec | P001379-5mg |
Ac-[Ala11,15]-Endothelin 1 (6-21) |
143113-45-5 | 5mg |
$375.00 | 2024-07-20 | ||
| AAPPTec | P001379-10mg |
Ac-[Ala11,15]-Endothelin 1 (6-21) |
143113-45-5 | 10mg |
$675.00 | 2024-07-20 | ||
| WU HAN AN JIE KAI Biomedical Technology Co., Ltd. | ajci13074-500ug |
BQ-3020 |
143113-45-5 | 98% | 500ug |
￥3572.00 | 2023-09-09 | |
| TRC | B703153-5mg |
BQ-3020 |
143113-45-5 | 5mg |
$ 50.00 | 2022-06-06 | ||
| TRC | B703153-10mg |
BQ-3020 |
143113-45-5 | 10mg |
$ 65.00 | 2022-06-06 | ||
| TRC | B703153-50mg |
BQ-3020 |
143113-45-5 | 50mg |
$ 115.00 | 2022-06-06 | ||
| A2B Chem LLC | AE33710-1mg |
BQ-3020 |
143113-45-5 | 1mg |
$248.00 | 2024-04-20 | ||
| A2B Chem LLC | AE33710-5mg |
BQ-3020 |
143113-45-5 | 5mg |
$542.00 | 2024-04-20 | ||
| A2B Chem LLC | AE33710-10mg |
BQ-3020 |
143113-45-5 | 10mg |
$895.00 | 2024-04-20 |
BQ-3020 Related Literature
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
-
Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
-
Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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