Chem
J-GLOBAL ID：200907002407355515
Nikkaji number：J2.639.453H
L-Arg-L-Leu-L-Leu-L-Leu-L-Pro-Gly-L-Glu-L-Leu-L-Ala-OH
L-Arg-L-Leu-L-Leu-L-Leu-L-Pro-Gly-L-Glu-L-Leu-L-Ala-OH
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
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
Molecular formula： C45H80N12O12
Molecular formula furigana： C45-H80-N12-O12
Molecular weight： 981.207
InChI：
InChI=1S/C45H80N12O12/c1-23(2)18-30(39(63)51-27(9)44(68)69)54-38(62)29(14-15-36(59)60)52-35(58)22-50-42(66)34-13-11-17-57(34)43(67)33(21-26(7)8)56-41(65)32(20-25(5)6)55-40(64)31(19-24(3)4)53-37(61)28(46)12-10-16-49-45(47)48/h23-34H,10-22,46H2,1-9H3,(H,50,66)(H,51,63)(H,52,58)(H,53,61)(H,54,62)(H,55,64)(H,56,65)(H,59,60)(H,68,69)(H4,47,48,49)/t27-,28-,29-,30-,31-,32-,33-,34-/m0/s1
InChI key：
RCIPZARLQNXCBL-LGYYRGKSSA-N
SMILES：
CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O
Systematic name (3)：
- L-Arg-L-Leu-L-Leu-L-Leu-L-Pro-Gly-L-Glu-L-Leu-L-Ala-OH
- (4S)-4-(2-{[(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-アミノ-5-カルバムイミドアミドペンタンアミド]-4-メチルペンタンアミド]-4-メチルペンタンアミド]-4-メチルペンタノイル]ピロリジン-2-イル]ホルムアミド}アセトアミド)-4-{[(1S)-1-{[(1S)-1-カルボキシエチル]カルバモイル}-3-メチルブチル]カルバモイル}ブタン酸
- (4S)-4-(2-{[(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-4-methylpentanamido]-4-methylpentanamido]-4-methylpentanoyl]pyrrolidin-2-yl]formamido}acetamido)-4-{[(1S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-3-methylbutyl]carbamoyl}butanoic acid
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