Chem
J-GLOBAL ID：200907055661219121   Nikkaji number：J1.704.567I

Tripropeptin D

トリプロペプチンD
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： C52H85N11O19
Molecular formula furigana： C52-H85-N11-O19
Molecular weight： 1168.310
InChI： InChI=1S/C52H85N11O19/c1-27(2)15-10-8-6-4-5-7-9-11-16-29-25-35(67)58-36(28(3)65)48(76)62-23-14-19-33(62)47(75)61-22-13-18-32(61)43(71)56-30(17-12-21-55-52(53)54)42(70)59-37(40(68)49(77)78)44(72)57-31(26-64)46(74)63-24-20-34(66)39(63)45(73)60-38(51(81)82-29)41(69)50(79)80/h27-34,36-41,64-66,68-69H,4-26H2,1-3H3,(H,56,71)(H,57,72)(H,58,67)(H,59,70)(H,60,73)(H,77,78)(H,79,80)(H4,53,54,55)/t28-,29?,30+,31+,32+,33+,34?,36+,37?,38+,39+,40?,41?/m1/s1
InChI key： DETFTHHTKCLOGR-OFSRPHHFSA-N
SMILES： CC(C)CCCCCCCCCCC1CC(=O)N[C@@H]([C@@H](C)O)C(=O)N2CCC[C@H]2C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(C(O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N2CCC(O)[C@H]2C(=O)N[C@@H](C(O)C(=O)O)C(=O)O1
Systematic name  (3)：
  • 2-デアミノ-3-(11-メチルドデシル)シクロ(L-Ser*-L-Thr-L-Pro-L-Pro-L-Arg-3-ヒドロキシ-L-Asp-L-Ser-3-ヒドロキシ-L-Pro-3-ヒドロキシ-L-Asp-)
  • 2-[(1S,7S,10S,13S,16S,22S,25S,32S)-10-(3-カルバムイミドアミドプロピル)-25-[カルボキシ(ヒドロキシ)メチル]-21-ヒドロキシ-32-[(1R)-1-ヒドロキシエチル]-16-(ヒドロキシメチル)-28-(11-メチルドデシル)-2,8,11,14,17,23,26,30,33-ノナオキソ-27-オキサ-3,9,12,15,18,24,31,34-オクタアザテトラシクロ[32.3.0.03,7.018,22]ヘプタトリアコンタン-13-イル]-2-ヒドロキシ酢酸
  • 2-[(1S,7S,10S,13S,16S,22S,25S,32S)-10-(3-carbamimidamidopropyl)-25-[carboxy(hydroxy)methyl]-21-hydroxy-32-[(1R)-1-hydroxyethyl]-16-(hydroxymethyl)-28-(11-methyldodecyl)-2,8,11,14,17,23,26,30,33-nonaoxo-27-oxa-3,9,12,15,18,24,31,34-octaazatetracyclo[32.3.0.03,7.018,22]heptatriacontan-13-yl]-2-hydroxyacetic acid
Other name (3)：
  • 2-Deamino-3-(11-methyldodecyl)cyclo(L-Ser*-L-Thr-L-Pro-L-Pro-L-Arg-3-hydroxy-L-Asp-L-Ser-3-hydroxy-L-Pro-3-hydroxy-L-Asp-)
  • トリプロペプチンD
  • Tripropeptin D
Thsaurus map：
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