Chem
J-GLOBAL ID：200907002197470421   Nikkaji number：J1.846.585J

(14bR)-8-[4-(Methoxycarbonyl)phenyl]-12-methoxy-9,10,14bβ,14cβ-tetrahydrobenzo[g]chrysene-2,6-dicarboxylic acid dimethyl ester

(14bR)-8-[4-(メトキシカルボニル)フェニル]-12-メトキシ-9,10,14bβ,14cβ-テトラヒドロベンゾ[g]クリセン-2,6-ジカルボン酸ジメチル
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： C35H30O7
Molecular formula furigana： C35-H30-O7
Molecular weight： 562.618
InChI： InChI=1S/C35H30O7/c1-39-24-11-14-25-21(15-24)9-13-27-31(25)29-16-22(34(37)41-3)10-12-26(29)30-18-23(35(38)42-4)17-28(32(27)30)19-5-7-20(8-6-19)33(36)40-2/h5-8,10-12,14-18,29,31H,9,13H2,1-4H3/t29-,31+/m1/s1
InChI key： FLCLNJYMRGURDA-VEEOACQBSA-N
SMILES： COC(=O)C1=C[C@H]2[C@@H]3C(=c4c(cc(cc4=C2C=C1)C(=O)OC)c1ccc(cc1)C(=O)OC)CCc1cc(OC)ccc31
Systematic name  (3)：
  • (14bR)-8-[4-(メトキシカルボニル)フェニル]-12-メトキシ-9,10,14bβ,14cβ-テトラヒドロベンゾ[g]クリセン-2,6-ジカルボン酸ジメチル
  • 2,6-ジメチル (14bR,14cS)-12-メトキシ-8-[4-(メトキシカルボニル)フェニル]-9H,10H,14bH,14cH-シクロヘキサ[g]クリセン-2,6-ジカルボキシラート
  • 2,6-dimethyl (14bR,14cS)-12-methoxy-8-[4-(methoxycarbonyl)phenyl]-9H,10H,14bH,14cH-cyclohexa[g]chrysene-2,6-dicarboxylate
Other name (1)：
  • (14bR)-8-[4-(Methoxycarbonyl)phenyl]-12-methoxy-9,10,14bβ,14cβ-tetrahydrobenzo[g]chrysene-2,6-dicarboxylic acid dimethyl ester
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