Chem
J-GLOBAL ID：200907052325419288   Nikkaji number：J1.902.646I

Cylindramide

シリンドラミド
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： C27H34N2O5
Molecular formula furigana： C27-H34-N2-O5
Molecular weight： 466.578
InChI： InChI=1S/C27H34N2O5/c1-16-11-12-19-18-8-3-2-4-10-23(32)28-14-13-22(31)25-26(33)24(27(34)29-25)21(30)9-6-5-7-17(18)15-20(16)19/h2-5,7,10-12,16-20,22,25,30-31H,6,8-9,13-15H2,1H3,(H,28,32)(H,29,34)/b3-2-,7-5-,10-4-,24-21-/t16-,17+,18-,19+,20+,22-,25-/m0/s1
InChI key： YVLAFZPZBWKPAA-XYOJDCOOSA-N
SMILES： C[C@H]1C=C[C@H]2[C@@H]1C[C@H]1/C=C\CC/C(=C\3/C(=O)N[C@@H]([C@@H](O)CCNC(=O)/C=C\C=C/C[C@H]21)C3=O)/O
Systematic name  (3)：
  • (4S,5S,8E,12E,14S,16R,17S,20S,21S,23Z,25E)-4,9-ジヒドロキシ-17-メチル-5,8-メタノ-14,21:16,20-ジシクロ-1,6-ジアザシクロヘプタコサ-8,12,18,23,25-ペンタエン-7,27,28-トリオン
  • (1Z,5Z,7S,9R,10S,13S,14S,16Z,18Z,24S,25S)-2,24-ジヒドロキシ-10-メチル-21,26-ジアザテトラシクロ[23.2.1.07,14.09,13]オクタコサ-1,5,11,16,18-ペンタエン-20,27,28-トリオン
  • (1Z,5Z,7S,9R,10S,13S,14S,16Z,18Z,24S,25S)-2,24-dihydroxy-10-methyl-21,26-diazatetracyclo[23.2.1.07,14.09,13]octacosa-1,5,11,16,18-pentaene-20,27,28-trione
Other name (3)：
  • (4S,5S,8E,12E,14S,16R,17S,20S,21S,23Z,25E)-4,9-Dihydroxy-17-methyl-5,8-methano-14,21:16,20-dicyclo-1,6-diazacycloheptacosa-8,12,18,23,25-pentene-7,27,28-trione
  • シリンドラミド
  • Cylindramide
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