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Isoleucine and derivatives
Description:
Compounds containing isoleucine or a derivative thereof resulting from reaction of isoleucine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
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D-allo-Isoleucine Ethyl Ester HydrochlorideCas Number: 315700-65-3 Compound CID: 86222804Formula: C8H18ClNO2 Molecular Weight: 195.69IUPAC Name: ethyl (2R,3S)-2-amino-3-methylpentanoate;hydrochlorideSMILES: CCC(C)C(C(=O)OCC)N.ClInChIKey: QQGRWNMNWONMOO-UOERWJHTSA-NInChI: InChI=1S/C8H17NO2.ClH/c1-4-6(3)7(9)8(10)11-5-2;/h6-7H,4-5,9H2,1-3H3;1H/t6-,7+;/m0./s1
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(±)-Jasmonic Acid-IsoleucineCas Number: 120330-93-0Formula: C18H29NO4 Molecular Weight: 323.43SMILES: CCC=CCC1C(CCC1=O)CC(=O)NC(C(C)CC)C(=O)OInChIKey: IBZYPBGPOGJMBF-QRHMYKSGSA-NInChI: show more
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(2S,3S)-2-((tert-Butoxycarbonyl)(methyl)amino)-3-methylpentanoic acidCas Number: 52498-32-5 Compound CID: 7017970Formula: C12H23NO4 Molecular Weight: 245.32IUPAC Name: (2S,3S)-3-methyl-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pentanoic acidSMILES: CCC(C)C(C(=O)O)N(C)C(=O)OC(C)(C)CInChIKey: HTBIAUMDQYXOFG-IUCAKERBSA-NInChI: InChI=1S/C12H23NO4/c1-7-8(2)9(10(14)15)13(6)11(16)17-12(3,4)5/h8-9H,7H2,1-6H3,(H,14,15)/t8-,9-/m0/s1
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L-IsoleucineCas Number: 73-32-5Formula: C6H13NO2 Molecular Weight: 131.18IUPAC Name: (2S,3S)-2-amino-3-methylpentanoic acidSMILES: CC[C@H](C)[C@@H](C(=O)O)NInChIKey: AGPKZVBTJJNPAG-WHFBIAKZSA-NInChI: InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1Synonyms: (2S,3S)-2-Amino-3-methylpentanoic acid | H-Ile-OH
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L-Isoleucine Ethyl Ester HydrochlorideIUPAC Name: ethyl (2S,3S)-2-amino-3-methylpentanoate;hydrochlorideSMILES: CCC(C)C(C(=O)OCC)N.ClInChIKey: QQGRWNMNWONMOO-LEUCUCNGSA-NInChI: InChI=1S/C8H17NO2.ClH/c1-4-6(3)7(9)8(10)11-5-2;/h6-7H,4-5,9H2,1-3H3;1H/t6-,7-;/m0./s1
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LM11A-31Cas Number: 102562-74-3Formula: C12H25N3O2 Molecular Weight: 243.35IUPAC Name: (2S,3S)-2-amino-3-methyl-N-(2-morpholin-4-ylethyl)pentanamideSMILES: CCC(C)C(C(=O)NCCN1CCOCC1)NInChIKey: YNMUTYLWSRFTPX-QWRGUYRKSA-NInChI: InChI=1S/C12H25N3O2/c1-3-10(2)11(13)12(16)14-4-5-15-6-8-17-9-7-15/h10-11H,3-9,13H2,1-2H3,(H,14,16)/t10-,11-/m0/s1
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2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-methylpentanoicacidCas Number: 2250198-69-5IUPAC Name: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylpentanoic acidSMILES: CCC(C)C(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13InChIKey: QXVFEIPAZSXRGM-UHFFFAOYSA-NInChI: InChI=1S/C21H23NO4/c1-3-13(2)19(20(23)24)22-21(25)26-12-18-16-10-6-4-8-14(16)15-9-5-7-11-17(15)18/h4-11,13,18-19H,3,12H2,1-2H3,(H,22,25)(H,23,24)
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N-Benzyl-L-isoleucineCas Number: 1859-49-0 Compound CID: 6994933Formula: C13H19NO2 Molecular Weight: 221.29IUPAC Name: (2S,3S)-2-(benzylamino)-3-methylpentanoic acidSMILES: CCC(C)C(C(=O)O)NCC1=CC=CC=C1InChIKey: GPAVORZIWQTJJQ-JQWIXIFHSA-NInChI: InChI=1S/C13H19NO2/c1-3-10(2)12(13(15)16)14-9-11-7-5-4-6-8-11/h4-8,10,12,14H,3,9H2,1-2H3,(H,15,16)/t10-,12-/m0/s1Synonyms: N-benzyl-isoleucine | SCHEMBL5658130 | AKOS026357474 | GPAVORZIWQTJJQ-JQWIXIFHSA-N | BZL-ILE-OH | n-benzyl-l-isoleuci...
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Fmoc-L-b-methylisoleucineCas Number: 1227750-73-3 Compound CID: 74889162Formula: C22H25NO4 Molecular Weight: 367.44IUPAC Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3,3-dimethylpentanoic acidSMILES: CCC(C)(C)C(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13InChIKey: KTFMEQGAIAYJMN-LJQANCHMSA-NInChI: show more
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(Rac)-LM11A-31 dihydrochlorideCas Number: 1214672-15-7 Compound CID: 43810708Formula: C12H27Cl2N3O2 Molecular Weight: 316.27IUPAC Name: 2-amino-3-methyl-N-(2-morpholin-4-ylethyl)pentanamide;dihydrochlorideSMILES: CCC(C)C(C(=O)NCCN1CCOCC1)N.Cl.ClInChIKey: LLIHJRRZJDEKLB-UHFFFAOYSA-NInChI: InChI=1S/C12H25N3O2.2ClH/c1-3-10(2)11(13)12(16)14-4-5-15-6-8-17-9-7-15;;/h10-11H,3-9,13H2,1-2H3,(H,14,16);2*1H
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Z-Ile-Leu-aldehydeCas Number: 161710-10-7 Compound CID: 44366908Formula: C20H30N2O4 Molecular Weight: 362.46IUPAC Name: benzyl N-[(2S,3S)-3-methyl-1-[[(2S)-4-methyl-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]carbamateSMILES: CCC(C)C(C(=O)NC(CC(C)C)C=O)NC(=O)OCC1=CC=CC=C1InChIKey: WJQLUFQGNVGLKR-SZMVWBNQSA-NInChI: show more
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4-Hydroxy IsoleucineCas Number: 781658-23-9Formula: C6H13NO3 Molecular Weight: 147.17IUPAC Name: (2S,3R)-2-amino-4-hydroxy-3-methylpentanoic acidSMILES: CC(C(C)O)C(C(=O)O)NInChIKey: OSCCDBFHNMXNME-DSDZBIDZSA-NInChI: InChI=1S/C6H13NO3/c1-3(4(2)8)5(7)6(9)10/h3-5,8H,7H2,1-2H3,(H,9,10)/t3-,4?,5-/m0/s1Synonyms: 4-?Hydroxy-?L-?isoleucine | 4-HYDROXY-L-ISOLEUCINE | (2S,3R)-2-amino-4-hydroxy-3-methylpentanoic acid | CCG-266183 | ...

