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Substance Name: Nelfinavir Mesylate [USAN]
RN: 159989-65-8
UNII: 98D603VP8V
InChIKey: NQHXCOAXSHGTIA-SKXNDZRYSA-N
Note
- A potent HIV protease inhibitor. It is used in combination with other antiviral drugs in the treatment of HIV in both adults and children.
Molecular Formula
- C32-H45-N3-O4-S.C-H4-O3-S
Molecular Weight
- 663.8961
- All
- Classifications
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Formulas
- Structure Descriptors
- Toxicity
Classification Codes
- Antiviral
- Drug / Therapeutic Agent
- Protease Inhibitor
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Names and Synonyms
Name of Substance
- Nelfinavir mesylate
- Nelfinavir Mesylate [USAN]
Synonyms
- (3S,4aS,8aS)-N-tert-Butyl-2-((2R,3R)-3-(3,2-cresotamido)-2-hydroxy-4-(phenylthio)butyl)decahydro-3-isoquinolinecarboxamide monomethanesulfonate (salt)
- AG 1343
- AG1343
- HSDB 7159
- Nelfinavir mesylate
- NFV
- UNII-98D603VP8V
- Viracept
Systematic Names
- 3-Isoquinolinecarboxamide, N-(1,1-dimethylethyl)decahydro-2-((2R,3R)-2-hydroxy-3-((3-hydroxy-2-methylbenzoyl)amino)-4-(phenylthio)butyl)-, (3S,4aS,8aS)-, monomethanesulfonate (salt)
- 3-Isoquinolinecarboxamide, N-(1,1-dimethylethyl)decahydro-2-(2-hydroxy-3-((3-hydroxy-2-methylbenzoyl)amino)-4-(phenylthio)butyl)-, (3S-(2(2,S*,3S*),3-alpha,4a-beta,8a-beta))-, monomethanesulfonate (salt)
Registry Numbers
CAS Registry Number
- 159989-65-8
FDA UNII
- 98D603VP8V
Related Registry Number
- 159989-64-7 (Parent)
System Generated Number
- 0159989658
Molecular Formulas
Molecular Formula
- C32-H45-N3-O4-S.C-H4-O3-S
Molecular Formula Fragments
- C-H4-O3-S
- C32-H45-N3-O4-S
- COMPONENT
Structure Descriptors
InChI
InChI=1S/C32H45N3O4S.CH4O3S/c1-21-25(15-10-16-28(21)36)30(38)33-26(20-40-24-13-6-5-7-14-24)29(37)19-35-18-23-12-9-8-11-22(23)17-27(35)31(39)34-32(2,3)4;1-5(2,3)4/h5-7,10,13-16,22-23,26-27,29,36-37H,8-9,11-12,17-20H2,1-4H3,(H,33,38)(H,34,39);1H3,(H,2,3,4)/t22-,23+,26-,27-,29+;/m0./s1InChIKey
NQHXCOAXSHGTIA-SKXNDZRYSA-NSmiles
Cc1c(O)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD | oral | > 500mg/kg (500mg/kg) | Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 40, Pg. 3395, 1998. | |
rat | LD | oral | > 500mg/kg (500mg/kg) | Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 40, Pg. 3395, 1998. |