Chem
J-GLOBAL ID:200907001524349538   Nikkaji number:J2.412.003A

Cycloamanide A

シクロアマニド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: C33H42N6O6
Molecular formula furigana: C33-H42-N6-O6
Molecular weight: 618.735
InChI: InChI=1S/C33H42N6O6/c1-20(2)28-33(45)37-25(18-23-13-8-5-9-14-23)31(43)36-24(17-22-11-6-4-7-12-22)30(42)35-21(3)29(41)34-19-27(40)39-16-10-15-26(39)32(44)38-28/h4-9,11-14,20-21,24-26,28H,10,15-19H2,1-3H3,(H,34,41)(H,35,42)(H,36,43)(H,37,45)(H,38,44)/t21-,24-,25-,26-,28-/m0/s1
InChI key: UROVRGVFEPXWAK-PKQHSRECSA-N
SMILES: CC(C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC1=O
Systematic name  (3):
  • シクロ[L-Ala-Gly-L-Pro-L-Val-L-Phe-L-Phe-]
  • (3S,6S,9S,12S,20aS)-6,9-ジベンジル-12-メチル-3-(プロパン-2-イル)-イコサヒドロピロロ[1,2-a]1,4,7,10,13,16-ヘキサアザシクロオクタデカン-1,4,7,10,13,16-ヘキサオン
  • (3S,6S,9S,12S,20aS)-6,9-dibenzyl-12-methyl-3-(propan-2-yl)-icosahydropyrrolo[1,2-a]1,4,7,10,13,16-hexaazacyclooctadecane-1,4,7,10,13,16-hexone
Other name (3):
  • Cyclo[L-Ala-Gly-L-Pro-L-Val-L-Phe-L-Phe-]
  • シクロアマニドA
  • Cycloamanide A
CAS registry number: 64644-55-9
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