Chem
J-GLOBAL ID：201507020464803865   Nikkaji number：J3.406.465B

novobenzomalvin A

ノボベンゾマルビン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： C26H22O2
Molecular formula furigana： C26-H22-O2
Molecular weight： 366.460
InChI： InChI=1S/C26H22O2/c27-24-16-19(14-17-8-2-1-3-9-17)23-15-18-10-4-5-11-20(18)26(28)25(23)22-13-7-6-12-21(22)24/h1-13,15,18-20,25H,14,16H2/t18?,19-,20?,25?/m0/s1
InChI key： NVEVNSTWWJFIJV-DYBVJONPSA-N
SMILES： O=C1C2C=CC=CC2C=C2C1c1ccccc1C(=O)C[C@@H]2Cc1ccccc1
Systematic name  (3)：
  • (7S)-7-ベンジル-6,7,12a,13a-テトラヒドロ-5H-ベンゾ[3,4]シクロヘプタ[1,2-b]ナフタレン-5,13(8aH)-ジオン
  • (10S)-10-ベンジルテトラシクロ[9.8.0.02,7.013,18]ノナデカ-2,4,6,11,14,16-ヘキサエン-8,19-ジオン
  • (10S)-10-benzyltetracyclo[9.8.0.02,7.013,18]nonadeca-2,4,6,11,14,16-hexaene-8,19-dione
Other name (3)：
  • (7S)-7-Benzyl-6,7,12a,13a-tetrahydro-5H-benzo[3,4]cyclohepta[1,2-b]naphthalene-5,13(8aH)-dione
  • novobenzomalvin A
  • ノボベンゾマルビンA
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