Chem
J-GLOBAL ID：200907080249687050
Nikkaji number：J2.704.587A
Arg-Ile-Lys-Ile-Gly-Leu-3-(2-Naphthyl)-Ala-NH2
Arg-Ile-Lys-Ile-Gly-Leu-3-(2-ナフチル)-Ala-NH2
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： C45H74N12O7
Molecular formula furigana： C45-H74-N12-O7
Molecular weight： 895.164
InChI：
InChI=1S/C45H74N12O7/c1-7-27(5)37(57-41(61)33(17-11-12-20-46)54-44(64)38(28(6)8-2)56-40(60)32(47)16-13-21-51-45(49)50)43(63)52-25-36(58)53-35(22-26(3)4)42(62)55-34(39(48)59)24-29-18-19-30-14-9-10-15-31(30)23-29/h9-10,14-15,18-19,23,26-28,32-35,37-38H,7-8,11-13,16-17,20-22,24-25,46-47H2,1-6H3,(H2,48,59)(H,52,63)(H,53,58)(H,54,64)(H,55,62)(H,56,60)(H,57,61)(H4,49,50,51)/t27-,28-,32-,33-,34-,35-,37-,38-/m0/s1
InChI key：
VQIJPWZZVJSECK-PJEIPZEXSA-N
SMILES：
CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N
Systematic name (3)：
- Arg-Ile-Lys-Ile-Gly-Leu-3-(2-ナフチル)-Ala-NH2
- (2S)-6-アミノ-2-[(2S,3S)-2-[(2S)-2-アミノ-5-カルバムイミドアミドペンタンアミド]-3-メチルペンタンアミド]-N-[(1S,2S)-1-[({[(1S)-1-{[(1S)-1-カルバモイル-2-(ナフタレン-2-イル)エチル]カルバモイル}-3-メチルブチル]カルバモイル}メチル)カルバモイル]-2-メチルブチル]ヘキサンアミド
- (2S)-6-amino-2-[(2S,3S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-methylpentanamido]-N-[(1S,2S)-1-[({[(1S)-1-{[(1S)-1-carbamoyl-2-(naphthalen-2-yl)ethyl]carbamoyl}-3-methylbutyl]carbamoyl}methyl)carbamoyl]-2-methylbutyl]hexanamide
- Arg-Ile-Lys-Ile-Gly-Leu-3-(2-Naphthyl)-Ala-NH2
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