Cas no 174022-42-5 (Bevirimat)
Bevirimat structure
Product Name:Bevirimat
CAS No:174022-42-5
MF:C36H56O6
MW:584.826251983643
MDL:MFCD00954243
CID:1066711
PubChem ID:457928
Update Time:2025-04-20
Bevirimat Chemical and Physical Properties
Names and Identifiers
-
- Bevirimat
- (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-(3-carboxy-3-methylbutanoyl)oxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3
- (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-(3-carboxy-3-methylbutanoyl)oxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid
- BVM
- DSB
- FH11327
- MPC-4326
- PA-457
- YK FH312
- YK-FH312
- (3b)-3-(3-Carboxy-3-methyl-1-oxobutoxy)lup-20(29)-en-28-oic acid
- 3-0-(3′-3′-Dimethylsuccinyl)betulinic acid
- O-(3,3-Dimethylsuccinyl)betulinic acid
- PA 457
- Bevirimat(PA-457)
- 3-O-(3',3'-Dimethylsuccinyl)betulinic acid
- 3-O-(3',3'-dimethylsuccinyl) betulinic acid
- S125DW66N8
- 3-O-(3',3'-Dimethylsuccinyl)-betulinic acid
- C36H56O6
- Bevirimat [INN]
- bevirimatum
- (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-(4-hydroxy-3,3-dimethyl-4-oxo-butanoy
- FH 11327
- 3-O-(3'',3''-dimethylsuccinyl)betulinic acid
- CCG-270147
- (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-(4-hydroxy-3,3-dimethyl-4-oxo-butanoyl)oxy-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid
- MS-30468
- DB06581
- PA-457;MPC-4326;YK FH312
- 2,2-Dimethyl-succinic acid 4-((1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a-carboxy-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-icosahydro-cyclopenta[a]chrysen-9-yl) ester
- CHEMBL404519
- Bevirimat; PA-457; MPC-4326
- (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-((3-carboxy-3-methylbutanoyl)oxy)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)icosahydro-3aH-cyclopenta[a]chrysene-3a-carboxylic acid
- UNII-S125DW66N8
- 2,2-Dimethyl-succinic acid, 4-((1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a-carboxy-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-eicosahydro-cyclopenta[a]chrysen-9-yl) ester
- Bevirimat, >=98% (HPLC)
- CHEBI:65484
- Q851897
- s9010
- BDBM50050955
- 174022-42-5
- MFCD00954243
- ZGA02242
- (3beta)-3-[(3-carboxy-3-methylbutanoyl)oxy]lup-20(29)-en-28-oic acid
- AKOS030526656
- AC-34026
- EX-A2381
- (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13bR)-9-(3-carboxy-3-methylbutanoyloxy)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)icosahydro-1H-cyclopenta[a]chrysene-3a-carboxylic acid
- 3-O-(3'',3''-dimethyl-succinyl)-betulinic acid
- SCHEMBL2612026
- Bevirimat(PA-457)?
- BEVIRIMAT [MI]
- 2I4
- NCGC00390568-02
- Lup-20(29)-en-28-oic acid, 3-(3-carboxy-3-methyl-1-oxobutoxy)-, (3beta)-
- ZB1856
- DBS, PA-457
- bevirimat-dimeglumine
- HY-N0842
- (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-((3-carboxy-3-methylbutanoyl)oxy)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)icosahydro-1H-cyclopenta[a]chrysene-3a-carboxylic acid
- 3-O-(3'',3''-dimethylsuccinyl)-betulinic acid
- 3alpha-[(3-carboxy-3-methylbutanoyl)oxy]-8alpha,9beta,10alpha,13alpha,17alpha,19beta-lup-20(29)-en-28-oic acid
- YJEJKUQEXFSVCJ-WRFMNRASSA-N
- NS00069609
- 3beta-(3-Carboxy-3-methylbutanoyloxy)lup-20(29)-en-28-oic acid
- DTXSID20169749
- PA-103001
- DTXCID5092240
- YK-FH 312
- PA457
- BRD-K16898998-001-01-6
- DA-61632
- (3beta)-3-((3-carboxy-3-methylbutanoyl)oxy)lup-20(29)-en-28-oic acid
- (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-(3-carboxy-3-methylbutanoyl)oxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta(a)chrysene-3a-carboxylic acid
- MPC4326
- dsb-2nmg
-
- MDL： MFCD00954243
- Inchi： 1S/C36H56O6/c1-21(2)22-12-17-36(30(40)41)19-18-34(8)23(28(22)36)10-11-25-33(7)15-14-26(42-27(37)20-31(3,4)29(38)39)32(5,6)24(33)13-16-35(25,34)9/h22-26,28H,1,10-20H2,2-9H3,(H,38,39)(H,40,41)/t22-,23+,24-,25+,26-,28+,33-,34+,35+,36-/m0/s1
- InChI Key： YJEJKUQEXFSVCJ-WRFMNRASSA-N
- SMILES： O(C(CC(C(=O)O)(C)C)=O)[C@H]1CC[C@@]2(C)[C@H](C1(C)C)CC[C@]1(C)[C@@H]2CC[C@@H]2[C@H]3[C@H](C(=C)C)CC[C@]3(C(=O)O)CC[C@@]12C
Computed Properties
- Exact Mass: 584.40800
- Monoisotopic Mass: 584.40768950 g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 42
- Rotatable Bond Count: 7
- Complexity: 1170
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 10
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 101
- Molecular Weight: 584.8
- XLogP3: 9.1
Experimental Properties
- Color/Form: Powder
- Density: 1.13±0.1 g/cm3 (20 oC 760 Torr),
- Melting Point: No data available
- Boiling Point: 662.7±40.0 °C at 760 mmHg
- Flash Point: 197.7±20.8 °C
- Solubility: Insuluble (1.3E-5 g/L) (25 oC),
- PSA: 100.90000
- LogP: 8.14130
- Vapor Pressure: No data available
Bevirimat Security Information
- Signal Word：warning
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
-
Warning Statement：
P264Thoroughly clean after treatment
P280Wear protective gloves/Wear protective clothing/Wear protective goggles/Wear a protective mask
P305If it enters the eyes
P351Rinse carefully with water for a few minutes
P338Remove the contact lens(If any)And easy to operate,Continue flushing
P337If eye irritation persists
P313Obtain medical advice/care - Hazardous Material transportation number：NONH for all modes of transport
- Safety Instruction： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Storage Condition：Powder -20°C 3 years ? 4°C 2 years In solvent -80°C 6 months ? -20°C 1 month
Bevirimat Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | B334700-2.5mg |
Bevirimat |
174022-42-5 | 2.5mg |
$ 176.00 | 2023-04-18 | ||
| TRC | B334700-25mg |
Bevirimat |
174022-42-5 | 25mg |
$ 1367.00 | 2023-04-18 | ||
| ChemScence | CS-3010-5mg |
Bevirimat |
174022-42-5 | 98.95% | 5mg |
$420.0 | 2022-04-27 | |
| ChemScence | CS-3010-10mg |
Bevirimat |
174022-42-5 | 98.95% | 10mg |
$600.0 | 2022-04-27 | |
| WU HAN AN JIE KAI Biomedical Technology Co., Ltd. | ajce55258-5mg |
Bevirimat |
174022-42-5 | 98% | 5mg |
￥2926.00 | 2023-09-07 | |
| WU HAN AN JIE KAI Biomedical Technology Co., Ltd. | ajce55258-10mg |
Bevirimat |
174022-42-5 | 98% | 10mg |
￥4180.00 | 2023-09-07 | |
| WU HAN AN JIE KAI Biomedical Technology Co., Ltd. | ajce55258-50mg |
Bevirimat |
174022-42-5 | 98% | 50mg |
￥0.00 | 2023-09-07 | |
| WU HAN AN JIE KAI Biomedical Technology Co., Ltd. | ajce55258-100mg |
Bevirimat |
174022-42-5 | 98% | 100mg |
￥0.00 | 2023-09-07 | |
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | T5782-5 mg |
Bevirimat |
174022-42-5 | 98.00% | 5mg |
￥2987.00 | 2022-04-26 | |
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | T5782-50 mg |
Bevirimat |
174022-42-5 | 98.00% | 50mg |
￥11948.00 | 2022-04-26 |
Bevirimat Related Literature
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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