Chem
J-GLOBAL ID：200907062792493829   Nikkaji number：J756.946G

Stellettadine A

ステレタジンA
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： C20H36N6O
Molecular formula furigana： C20-H36-N6-O
Molecular weight： 376.549
InChI： InChI=1S/C20H36N6O/c1-15(2)9-7-10-16(3)11-8-12-17(4)18(27)26-20(23)25-14-6-5-13-24-19(21)22/h8-9,11-12,16H,5-7,10,13-14H2,1-4H3,(H4,21,22,24)(H3,23,25,26,27)/b11-8+,17-12+/t16-/m0/s1
InChI key： HKFHCLUMLQKJJJ-QVCSGVSCSA-N
SMILES： C[C@@H](CCC=C(C)C)/C=C/C=C(\C)/C(=O)NC(=N)NCCCCNC(=N)N
Systematic name  (3)：
  • (2E,4E,6S)-1-[3-(4-グアニジノブチル)グアニジノ]-2,6,10-トリメチル-2,4,9-ウンデカトリエン-1-オン
  • (2E,4E,6S)-N-[N-(4-カルバムイミドアミドブチル)カルバムイミドイル]-2,6,10-トリメチルウンデカ-2,4,9-トリエンアミド
  • (2E,4E,6S)-N-[N-(4-carbamimidamidobutyl)carbamimidoyl]-2,6,10-trimethylundeca-2,4,9-trienamide
Other name (4)：
  • ステレタジンA
  • Stellettadine A
  • (2E,4E,6S)-1-[3-(4-Guanidinobutyl)guanidino]-2,6,10-trimethyl-2,4,9-undecatrien-1-one
  • ステレッタジンA
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