Chem
J-GLOBAL ID:200907092345540271
Nikkaji number:J784.182E
L-Leu-L-Leu-L-Tyr-L-Gln-L-Gln-L-Pro-L-Val-OH
L-Leu-L-Leu-L-Tyr-L-Gln-L-Gln-L-Pro-L-Val-OH
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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:
C41 H65 N9 O11
Molecular formula furigana:
C41-H65-N9-O11
Molecular weight:
860.023
InChI:
InChI=1S/C41H65N9O11/c1-21(2)18-26(42)35(54)47-29(19-22(3)4)37(56)48-30(20-24-9-11-25(51)12-10-24)38(57)45-27(13-15-32(43)52)36(55)46-28(14-16-33(44)53)40(59)50-17-7-8-31(50)39(58)49-34(23(5)6)41(60)61/h9-12,21-23,26-31,34,51H,7-8,13-20,42H2,1-6H3,(H2,43,52)(H2,44,53)(H,45,57)(H,46,55)(H,47,54)(H,48,56)(H,49,58)(H,60,61)/t26-,27-,28-,29-,30-,31-,34-/m0/s1
InChI key:
XAUNJFUFZVSUKN-LOIOPFQMSA-N
SMILES:
CC(C)C[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)O
Systematic name (3):
L-Leu-L-Leu-L-Tyr-L-Gln-L-Gln-L-Pro-L-Val-OH
(2S)-2-{[(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-アミノ-4-メチルペンタンアミド]-4-メチルペンタンアミド]-3-(4-ヒドロキシフェニル)プロパンアミド]-4-カルバモイルブタンアミド]-4-カルバモイルブタノイル]ピロリジン-2-イル]ホルムアミド}-3-メチルブタン酸
(2S)-2-{[(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-methylpentanamido]-3-(4-hydroxyphenyl)propanamido]-4-carbamoylbutanamido]-4-carbamoylbutanoyl]pyrrolidin-2-yl]formamido}-3-methylbutanoic acid
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