Chem
J-GLOBAL ID：200907058900742973   Nikkaji number：J423.318B

Caulerpin

カウレルピン
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： C24H18N2O4
Molecular formula furigana： C24-H18-N2-O4
Molecular weight： 398.418
InChI： InChI=1S/C24H18N2O4/c1-29-23(27)17-11-15-13-7-3-6-10-20(13)26-22(15)18(24(28)30-2)12-16-14-8-4-5-9-19(14)25-21(16)17/h3-12,25-26H,1-2H3/b15-11-,16-12?,17-11?,18-12?,21-17?,22-18-
InChI key： PVWALMHWUOWPPA-PDFJCADOSA-N
SMILES： COC(=O)c1c2[nH]c3ccccc3c2cc(C(=O)OC)c2[nH]c3ccccc3c2c1
Systematic name  (3)：
  • 5,12-ジヒドロシクロオクタ[1,2-b:5,6-b′]ジインドール-6,13-ジカルボン酸ジメチル
  • 2,13-ジメチル (3Z,12Z)-11,22-ジアザペンタシクロ[13.7.0.04,12.05,10.016,21]ドコサ-1,3,5,7,9,12,14,16,18,20-デカエン-2,13-ジカルボキシラート
  • 2,13-dimethyl (3Z,12Z)-11,22-diazapentacyclo[13.7.0.04,12.05,10.016,21]docosa-1,3,5,7,9,12,14,16,18,20-decaene-2,13-dicarboxylate
Other name (3)：
  • カウレルピン
  • Caulerpin
  • 5,12-Dihydrocycloocta[1,2-b:5,6-b′]diindole-6,13-dicarboxylic acid dimethyl ester
CAS registry number： 26612-48-6
KEGG COMPOUND： C17097
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