Chem
J-GLOBAL ID:200907066007990066   Nikkaji number:J1.184.485E

VE20

L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-OH
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C100H162N20O41
Molecular formula furigana: C100-H162-N20-O41
Molecular weight: 2300.495
InChI: InChI=1S/C100H162N20O41/c1-41(2)71(101)90(150)102-51(21-31-61(121)122)81(141)112-72(42(3)4)91(151)103-52(22-32-62(123)124)82(142)113-73(43(5)6)92(152)104-53(23-33-63(125)126)83(143)114-74(44(7)8)93(153)105-54(24-34-64(127)128)84(144)115-75(45(9)10)94(154)106-55(25-35-65(129)130)85(145)116-76(46(11)12)95(155)107-56(26-36-66(131)132)86(146)117-77(47(13)14)96(156)108-57(27-37-67(133)134)87(147)118-78(48(15)16)97(157)109-58(28-38-68(135)136)88(148)119-79(49(17)18)98(158)110-59(29-39-69(137)138)89(149)120-80(50(19)20)99(159)111-60(100(160)161)30-40-70(139)140/h41-60,71-80H,21-40,101H2,1-20H3,(H,102,150)(H,103,151)(H,104,152)(H,105,153)(H,106,154)(H,107,155)(H,108,156)(H,109,157)(H,110,158)(H,111,159)(H,112,141)(H,113,142)(H,114,143)(H,115,144)(H,116,145)(H,117,146)(H,118,147)(H,119,148)(H,120,149)(H,121,122)(H,123,124)(H,125,126)(H,127,128)(H,129,130)(H,131,132)(H,133,134)(H,135,136)(H,137,138)(H,139,140)(H,160,161)/t51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-/m0/s1
InChI key: OTGDOHMZQWAOER-AVWMYISRSA-N
SMILES: CC(C)[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O
Systematic name  (3):
  • L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-L-Val-L-Glu-OH
  • (2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-アミノ-3-メチルブタンアミド]-4-カルボキシブタンアミド]-3-メチルブタンアミド]-4-カルボキシブタンアミド]-3-メチルブタンアミド]-4-カルボキシブタンアミド]-3-メチルブタンアミド]-4-カルボキシブタンアミド]-3-メチルブタンアミド]-4-カルボキシブタンアミド]-3-メチルブタンアミド]-4-カルボキシブタンアミド]-3-メチルブタンアミド]-4-カルボキシブタンアミド]-3-メチルブタンアミド]-4-カルボキシブタンアミド]-3-メチルブタンアミド]-4-カルボキシブタンアミド]-3-メチルブタンアミド]ペンタン二酸
  • (2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-4-carboxybutanamido]-3-methylbutanamido]-4-carboxybutanamido]-3-methylbutanamido]-4-carboxybutanamido]-3-methylbutanamido]-4-carboxybutanamido]-3-methylbutanamido]-4-carboxybutanamido]-3-methylbutanamido]-4-carboxybutanamido]-3-methylbutanamido]-4-carboxybutanamido]-3-methylbutanamido]-4-carboxybutanamido]-3-methylbutanamido]-4-carboxybutanamido]-3-methylbutanamido]pentanedioic acid
Other name (1):
  • VE20
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