Valine and derivatives

Description:

Compounds containing valine or a derivative thereof resulting from reaction of valine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

Ancestors:

Organic compounds ⮕ Organic acids and derivatives ⮕ Carboxylic acids and derivatives ⮕ Amino acids, peptides, and analogues ⮕ Amino acids and derivatives ⮕ Alpha amino acids and derivatives ⮕ Valine and derivatives

(2S)-3-methyl-2-(pyrrolidin-1-yl)butanoic acid
- ≥97%
Cas Number: 777839-82-4 Compound CID: 42299131

Formula: C₉H₁₇NO₂ Molecular Weight: 171.24

IUPAC Name: (2S)-3-methyl-2-pyrrolidin-1-ylbutanoic acid

SMILES: CC(C)C(C(=O)O)N1CCCC1

InChIKey: XXAWWQYJXDAKIM-QMMMGPOBSA-N

InChI: InChI=1S/C9H17NO2/c1-7(2)8(9(11)12)10-5-3-4-6-10/h7-8H,3-6H2,1-2H3,(H,11,12)/t8-/m0/s1

Synonyms: (S)-3-Methyl-2-(1-pyrrolidinyl)butyric Acid | 777839-82-4 | (2S)-3-METHYL-2-(PYRROLIDIN-1-YL)BUTANOIC ACID | (2S)-3-m...
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Pricing Close
(2S)-2-amino-N,N-diethyl-3-methyl-butanamide
- ≥97%
Cas Number: 56414-87-0 Compound CID: 11435211

Formula: C₉H₂₀N₂O Molecular Weight: 172.27

IUPAC Name: (2S)-2-amino-N,N-diethyl-3-methylbutanamide

SMILES: CCN(CC)C(=O)C(C(C)C)N

InChIKey: VMRKJJQTRYRJRT-QMMMGPOBSA-N

InChI: InChI=1S/C9H20N2O/c1-5-11(6-2)9(12)8(10)7(3)4/h7-8H,5-6,10H2,1-4H3/t8-/m0/s1

Synonyms: (S)-2-Amino-N,N-diethyl-3-methylbutanamide | PS-18770 | (2S)-2-amino-N,N-diethyl-3-methylbutanamide | (2S)-2-amino-N,...
Details

Pricing Close
(S)-(+)-2-Amino-3-hydroxy-3-methylbutanoic acid
- ≥97%
Cas Number: 2280-27-5 EC Number: 870-221-2 Compound CID: 192763

Formula: C₅H₁₁NO₃ Molecular Weight: 133.14

IUPAC Name: (2S)-2-amino-3-hydroxy-3-methylbutanoic acid

SMILES: CC(C)(C(C(=O)O)N)O

InChIKey: LDRFQSZFVGJGGP-GSVOUGTGSA-N

InChI: InChI=1S/C5H11NO3/c1-5(2,9)3(6)4(7)8/h3,9H,6H2,1-2H3,(H,7,8)/t3-/m1/s1

Synonyms: beta-Hydroxy-L-valine | 3-Hydroxy-L-valine | (S)-2-Amino-3-hydroxy-3-methylbutanoic acid | (2S)-2-amino-3-hydroxy-3-m...
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Pricing Close
(2R)-2-(tert-butoxycarbonylamino)-3-hydroxy-3-methyl-butanoic acid
- ≥97%
Cas Number: 288159-40-0 Compound CID: 11299247

Formula: C₁₀H₁₉NO₅ Molecular Weight: 233.27

IUPAC Name: (2R)-3-hydroxy-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid

SMILES: CC(C)(C)OC(=O)NC(C(=O)O)C(C)(C)O

InChIKey: SZVRVSZFEDIMFM-LURJTMIESA-N

InChI: InChI=1S/C10H19NO5/c1-9(2,3)16-8(14)11-6(7(12)13)10(4,5)15/h6,15H,1-5H3,(H,11,14)(H,12,13)/t6-/m0/s1

Synonyms: DS-4595 | (R)-2-(tert-butoxycarbonylamino)-3-hydroxy-3-methylbutanoic acid | Boc-(R)-2-amino-3-methylbutanoic acid | ...
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Pricing Close
[³H]valsartan
IUPAC Name: (2S)-3-methyl-2-[pentanoyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoic acid

SMILES: CCCCC(=O)N([C@H](C(=O)O)C(C)C)Cc1ccc(cc1)c1ccccc1c1nnn[nH]1

InChIKey: ACWBQPMHZXGDFX-QFIPXVFZSA-N

InChI: InChI=1S/C24H29N5O3/c1-4-5-10-21(30)29(22(16(2)3)24(31)32)15-17-11-13-18(14-12-17)19-8-6-7-9-20(19)23-25-27-28-26-23/h6-9,11-14,16,22H,4-5,10,15H2,1-3show more

Synonyms: HSDB 7519 | Valsartan [USAN:USP:INN:BAN] | 80M03YXJ7I | Tareg | VALSARTAN (USP-RS) | MLS001424088 | VALSARTAN [INN] |...
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Pricing Close
His-Leu-lopinavir
SMILES: CC(CC(CC(=O)O[C@H]([C@H](Cc1ccccc1)NC(=O)COc1c(C)cccc1C)C[C@@H](NC(=O)[C@@H](N1CCCNC1=O)C(C)C)Cc1ccccc1)NC(=O)CC(Cc1c[nH]cn1)N)C

InChIKey: CNRARJITWNMDCM-XGZCXRAPSA-N

InChI: InChI=1S/C51H70N8O7/c1-33(2)23-40(56-45(60)27-39(52)26-42-30-53-32-55-42)29-47(62)66-44(43(25-38-19-11-8-12-20-38)58-46(61)31-65-49-35(5)15-13-16-36(4show more

Synonyms: His-Leu-LPV | Histidine-Leucine-Lopinavir
Details

Pricing Close
group E 1682-2106
IUPAC Name: 3-methyl-2-[(5Z)-5-(1-methyl-2-oxoindol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid

SMILES: CC(C(N1C(=S)S/C(=C\2/c3ccccc3N(C2=O)C)/C1=O)C(=O)O)C

InChIKey: ICRQMQBVDGOOFY-QBFSEMIESA-N

InChI: InChI=1S/C17H16N2O4S2/c1-8(2)12(16(22)23)19-15(21)13(25-17(19)24)11-9-6-4-5-7-10(9)18(3)14(11)20/h4-8,12H,1-3H3,(H,22,23)/b13-11-
Details

Pricing Close
MRK-1
Cas Number: 313994-79-5 Compound CID: 5481119

IUPAC Name: (2R)-2-[[(1R,3S,4S)-3-[[4-[2-ethyl-5-(phenylmethyl)pyrazol-3-yl]piperidin-1-yl]methyl]-4-(3-fluorophenyl)cyclopentyl]-methylamino]-3-methylbutanoic acshow more

SMILES: CCn1nc(cc1C1CCN(CC1)C[C@H]1C[C@@H](C[C@@H]1c1cccc(c1)F)N([C@@H](C(=O)O)C(C)C)C)Cc1ccccc1

InChIKey: ZTENZJJCFACIAK-ADWVOTLJSA-N

InChI: InChI=1S/C35H47FN4O2/c1-5-40-33(21-30(37-40)18-25-10-7-6-8-11-25)26-14-16-39(17-15-26)23-28-20-31(38(4)34(24(2)3)35(41)42)22-32(28)27-12-9-13-29(36)19show more

Synonyms: Tox21_300223 | DTXCID8027327 | MK-578 | Q27087736 | CAS-313994-79-5 | (2R)-2-[[(1R,3S,4S)-3-[[4-(5-benzyl-2-ethyl-pyr...
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Pricing Close
CGS-27023A
IUPAC Name: (2R)-N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-3-methylbutanamide

SMILES: ONC(=O)[C@H](N(S(=O)(=O)c1ccc(cc1)OC)Cc1cccnc1)C(C)C

InChIKey: BSIZUMJRKYHEBR-QGZVFWFLSA-N

InChI: InChI=1S/C18H23N3O5S/c1-13(2)17(18(22)20-23)21(12-14-5-4-10-19-11-14)27(24,25)16-8-6-15(26-3)7-9-16/h4-11,13,17,23H,12H2,1-3H3,(H,20,22)/t17-/m1/s1

Synonyms: CGS27023Afree | SCHEMBL3468445 | (R)-N-Hydroxy-2-[(4-methoxy-benzenesulfonyl)-pyridin-3-ylmethyl-amino]-3-methyl-buty...
Details

Pricing Close
(S)-2-((Methoxycarbonyl)amino)-3,3-dimethylbutanoic acid
- ≥97%
Cas Number: 162537-11-3 EC Number: 431-620-3, 605-292-9 Compound CID: 11263950

Formula: C₈H₁₅NO₄ Molecular Weight: 189.21

IUPAC Name: (2S)-2-(methoxycarbonylamino)-3,3-dimethylbutanoic acid

SMILES: CC(C)(C)C(C(=O)O)NC(=O)OC

InChIKey: NWPRXAIYBULIEI-RXMQYKEDSA-N

InChI: InChI=1S/C8H15NO4/c1-8(2,3)5(6(10)11)9-7(12)13-4/h5H,1-4H3,(H,9,12)(H,10,11)/t5-/m1/s1

Synonyms: N-Methoxycarbonyl-L-tert-leucine | EN300-6347568 | MFCD07778455 | (S)-2-((Methoxycarbonyl)amino)-3,3-dimethylbutanoic...
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Pricing Close
L-Valine-1-¹³C
- ≥99 atom% 13C
Cas Number: 81201-85-6

Formula: (CH₃)₂CHCH(NH₂)13CO₂H Molecular Weight: 118.14

IUPAC Name: (2S)-2-amino-3-methyl(113C)butanoic acid

SMILES: CC(C)C(C(=O)O)N

InChIKey: KZSNJWFQEVHDMF-TXZHAAMZSA-N

InChI: InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1/i5+1

Synonyms: L-Valine-1-13C, 99 atom % 13C | L-Valine-1-13C, S & P tested, 99 atom % 13C | L-Valine-1-13C | DTXSID40453298 | HY-N0...
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Pricing Close
L-Valine-d₈
- ≥98 atom% D,≥98%
Cas Number: 35045-72-8

Formula: C5H3D8NO2

IUPAC Name: (2S)-2-amino-2,3,4,4,4-pentadeuterio-3-(trideuteriomethyl)butanoic acid

SMILES: CC(C)C(C(=O)O)N

InChIKey: KZSNJWFQEVHDMF-AYWPRJOCSA-N

InChI: InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1/i1D3,2D3,3D,4D

Synonyms: CHEBI:192086 | DTXSID00479090 | HY-I1124 | L-VALINE-2,3,4,4,4,5,5,5-D8 | L-Valine-d8 | (2S)-2-amino-2,3,4,4,4-pentade...
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