Chem
J-GLOBAL ID：200907049325029225   Nikkaji number：J496.750J

Malformin A1

マルホルミンA1
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： C23H39N5O5S2
Molecular formula furigana： C23-H39-N5-O5-S2
Molecular weight： 529.720
InChI： InChI=1S/C23H39N5O5S2/c1-7-13(6)18-23(33)26-15-9-34-35-10-16(25-20(15)30)21(31)27-17(12(4)5)22(32)24-14(8-11(2)3)19(29)28-18/h11-18H,7-10H2,1-6H3,(H,24,32)(H,25,30)(H,26,33)(H,27,31)(H,28,29)/t13-,14+,15+,16+,17-,18-/m0/s1
InChI key： RNCGDQLZIATDOU-ZDRBWGSPSA-N
SMILES： CC[C@H](C)[C@@H]1NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H]2CSSC[C@@H](NC1=O)C(=O)N2)C(C)C
Systematic name  (3)：
  • シクロ(D-Cys(1)-D-Cys(1)-L-Val-D-Leu-L-Ile-)
  • (1S,4S,7R,10S,13S)-4-[(2S)-ブタン-2-イル]-7-(2-メチルプロピル)-10-(プロパン-2-イル)-15,16-ジチア-2,5,8,11,19-ペンタアザビシクロ[11.4.2]ノナデカン-3,6,9,12,18-ペンタオン
  • (1S,4S,7R,10S,13S)-4-[(2S)-butan-2-yl]-7-(2-methylpropyl)-10-(propan-2-yl)-15,16-dithia-2,5,8,11,19-pentaazabicyclo[11.4.2]nonadecane-3,6,9,12,18-pentone
Other name (5)：
  • マルホルミンA1
  • Malformin A1
  • Cyclo(D-Cys(1)-D-Cys(1)-L-Val-D-Leu-L-Ile-)
  • マルホルミンA1
  • Malformin A1
Thsaurus map：
Thesaurus Map

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