Chem
J-GLOBAL ID：200907076376716003   Nikkaji number：J2.108.385B

Boneratamide A

ボネラタミド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： C24H38N2O4
Molecular formula furigana： C24-H38-N2-O4
Molecular weight： 418.578
InChI： InChI=1S/C24H38N2O4/c1-14(2)17-8-7-16(4)24(12-11-15(3)13-24)20(17)25-22(30)23(5,6)26-18(21(28)29)9-10-19(26)27/h13-14,16-18,20H,7-12H2,1-6H3,(H,25,30)(H,28,29)/t16-,17+,18-,20-,24-/m1/s1
InChI key： CIYFWEZTKZBJJG-DGPQGTHCSA-N
SMILES： CC(C)[C@@H]1CC[C@@H](C)[C@]2(CCC(=C2)C)[C@@H]1NC(=O)C(C)(C)N1[C@H](CCC1=O)C(=O)O
Systematic name  (3)：
  • (2R)-1-[2-[[(1R,2S,5R,6S)-2-イソプロピル-5,9-ジメチルスピロ[5.4]デカ-9-エン-1-イル]アミノ]-1,1-ジメチル-2-オキソエチル]-5-オキソピロリジン-2-カルボン酸
  • (2R)-1-(1-{[(5S,6R,7S,10R)-2,10-ジメチル-7-(プロパン-2-イル)スピロ[4.5]デカ-1-エン-6-イル]カルバモイル}-1-メチルエチル)-5-オキソピロリジン-2-カルボン酸
  • (2R)-1-(1-{[(5S,6R,7S,10R)-2,10-dimethyl-7-(propan-2-yl)spiro[4.5]dec-1-en-6-yl]carbamoyl}-1-methylethyl)-5-oxopyrrolidine-2-carboxylic acid
Other name (3)：
  • (2R)-1-[2-[[(1R,2S,5R,6S)-2-Isopropyl-5,9-dimethylspiro[5.4]deca-9-ene-1-yl]amino]-1,1-dimethyl-2-oxoethyl]-5-oxopyrrolidine-2-carboxylic acid
  • ボネラタミドA
  • Boneratamide A
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