Chem
J-GLOBAL ID：200907050191212638   Nikkaji number：J1.010.882I

N-(3-Mercaptopropionyl)-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-(benzyloxy)NH2

N-(3-メルカプトプロピオニル)-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-(ベンジルオキシ)NH2
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： C66H109N17O18S
Molecular formula furigana： C66-H109-N17-O18-S
Molecular weight： 1460.760
InChI： InChI=1S/C66H109N17O18S/c1-33(67-42(84)30-31-102)43(85)75-59(9,10)51(93)68-34(2)44(86)76-60(11,12)52(94)69-35(3)45(87)77-61(13,14)53(95)70-36(4)46(88)78-62(15,16)54(96)71-37(5)47(89)79-63(17,18)55(97)72-38(6)48(90)80-64(19,20)56(98)73-39(7)49(91)81-65(21,22)57(99)74-40(8)50(92)82-66(23,24)58(100)83-101-32-41-28-26-25-27-29-41/h25-29,33-40,102H,30-32H2,1-24H3,(H,67,84)(H,68,93)(H,69,94)(H,70,95)(H,71,96)(H,72,97)(H,73,98)(H,74,99)(H,75,85)(H,76,86)(H,77,87)(H,78,88)(H,79,89)(H,80,90)(H,81,91)(H,82,92)(H,83,100)/t33-,34-,35-,36-,37-,38-,39-,40-/m0/s1
InChI key： UBHAQOIJMNFZGK-TZPCGENMSA-N
SMILES： C[C@H](NC(=O)CCS)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)NOCc1ccccc1
Systematic name  (3)：
  • N-(3-メルカプトプロピオニル)-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-(ベンジルオキシ)NH2
  • N-[(1S)-1-[(1-{[(1S)-1-[(1-{[(1S)-1-[(1-{[(1S)-1-[(1-{[(1S)-1-[(1-{[(1S)-1-[(1-{[(1S)-1-({1-[(ベンジルオキシ)カルバモイル]-1-メチルエチル}カルバモイル)エチル]カルバモイル}-1-メチルエチル)カルバモイル]エチル]カルバモイル}-1-メチルエチル)カルバモイル]エチル]カルバモイル}-1-メチルエチル)カルバモイル]エチル]カルバモイル}-1-メチルエチル)カルバモイル]エチル]カルバモイル}-1-メチルエチル)カルバモイル]エチル]カルバモイル}-1-メチルエチル)カルバモイル]エチル]-2-メチル-2-[(2S)-2-(3-スルファニルプロパンアミド)プロパンアミド]プロパンアミド
  • N-[(1S)-1-[(1-{[(1S)-1-[(1-{[(1S)-1-[(1-{[(1S)-1-[(1-{[(1S)-1-[(1-{[(1S)-1-[(1-{[(1S)-1-({1-[(benzyloxy)carbamoyl]-1-methylethyl}carbamoyl)ethyl]carbamoyl}-1-methylethyl)carbamoyl]ethyl]carbamoyl}-1-methylethyl)carbamoyl]ethyl]carbamoyl}-1-methylethyl)carbamoyl]ethyl]carbamoyl}-1-methylethyl)carbamoyl]ethyl]carbamoyl}-1-methylethyl)carbamoyl]ethyl]carbamoyl}-1-methylethyl)carbamoyl]ethyl]-2-methyl-2-[(2S)-2-(3-sulfanylpropanamido)propanamido]propanamide
Other name (1)：
  • N-(3-Mercaptopropionyl)-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-Ala-Aib-(benzyloxy)NH2
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM