Chem
J-GLOBAL ID:200907093313871698   Nikkaji number:J2.644.496I

L-Ile-L-Thr-L-Asp-L-Ser-L-Ile-L-Ile-L-Ile-L-Ile-L-Ser-L-Trp-L-Ile-Gly-OH

L-Ile-L-Thr-L-Asp-L-Ser-L-Ile-L-Ile-L-Ile-L-Ile-L-Ser-L-Trp-L-Ile-Gly-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: C63H103N13O18
Molecular formula furigana: C63-H103-N13-O18
Molecular weight: 1330.590
InChI: InChI=1S/C63H103N13O18/c1-14-30(7)46(64)57(88)76-52(36(13)79)63(94)68-41(25-44(80)81)53(84)69-43(29-78)56(87)72-49(33(10)17-4)60(91)74-51(35(12)19-6)62(93)75-50(34(11)18-5)61(92)73-48(32(9)16-3)59(90)70-42(28-77)55(86)67-40(24-37-26-65-39-23-21-20-22-38(37)39)54(85)71-47(31(8)15-2)58(89)66-27-45(82)83/h20-23,26,30-36,40-43,46-52,65,77-79H,14-19,24-25,27-29,64H2,1-13H3,(H,66,89)(H,67,86)(H,68,94)(H,69,84)(H,70,90)(H,71,85)(H,72,87)(H,73,92)(H,74,91)(H,75,93)(H,76,88)(H,80,81)(H,82,83)/t30-,31-,32-,33-,34-,35-,36+,40-,41-,42-,43-,46-,47-,48-,49-,50-,51-,52-/m0/s1
InChI key: WGWCUKINRWWKSM-FOUHJYROSA-N
SMILES: CC[C@H](C)[C@H](N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)O
Systematic name  (3):
  • L-Ile-L-Thr-L-Asp-L-Ser-L-Ile-L-Ile-L-Ile-L-Ile-L-Ser-L-Trp-L-Ile-Gly-OH
  • (3S)-3-[(2S,3R)-2-[(2S,3S)-2-アミノ-3-メチルペンタンアミド]-3-ヒドロキシブタンアミド]-3-{[(1S)-1-{[(1S,2S)-1-{[(1S,2S)-1-{[(1S,2S)-1-{[(1S,2S)-1-{[(1S)-1-{[(1S)-1-{[(1S,2S)-1-[(カルボキシメチル)カルバモイル]-2-メチルブチル]カルバモイル}-2-(1H-インドール-3-イル)エチル]カルバモイル}-2-ヒドロキシエチル]カルバモイル}-2-メチルブチル]カルバモイル}-2-メチルブチル]カルバモイル}-2-メチルブチル]カルバモイル}-2-メチルブチル]カルバモイル}-2-ヒドロキシエチル]カルバモイル}プロパン酸
  • (3S)-3-[(2S,3R)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-hydroxybutanamido]-3-{[(1S)-1-{[(1S,2S)-1-{[(1S,2S)-1-{[(1S,2S)-1-{[(1S,2S)-1-{[(1S)-1-{[(1S)-1-{[(1S,2S)-1-[(carboxymethyl)carbamoyl]-2-methylbutyl]carbamoyl}-2-(1H-indol-3-yl)ethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}-2-methylbutyl]carbamoyl}-2-methylbutyl]carbamoyl}-2-methylbutyl]carbamoyl}-2-methylbutyl]carbamoyl}-2-hydroxyethyl]carbamoyl}propanoic acid
Thsaurus map:

Return to Previous Page