Chem
J-GLOBAL ID：200907032216475347   Nikkaji number：J2.319.870C

Kadsuralignan D

カズラリグナンD
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： C23H28O7
Molecular formula furigana： C23-H28-O7
Molecular weight： 416.470
InChI： InChI=1S/C23H28O7/c1-11-8-13-9-15(25-3)20(28-6)22(24)23(13)17-14(18(30-23)12(11)2)10-16(26-4)19(27-5)21(17)29-7/h9-12,18H,8H2,1-7H3/t11-,12-,18-,23+/m1/s1
InChI key： FFSFOPWUUXUQHZ-SDVNKKRHSA-N
SMILES： COC1=C(OC)C(=O)[C@]23O[C@H]([C@H](C)[C@H](C)CC2=C1)c1cc(OC)c(OC)c(OC)c31
Systematic name  (3)：
  • 5,6,7,8-テトラヒドロ-12H-5α,12aα-エポキシ-1,2,3,10,11-ペンタメトキシ-6α,7α-ジメチルジベンゾ[a,c]シクロオクテン-12-オン
  • (1S,8R,9R,10R)-3,4,13,14,15-ペンタメトキシ-8,9-ジメチル-17-オキサテトラシクロ[8.6.1.01,6.011,16]ヘプタデカ-3,5,11,13,15-ペンタエン-2-オン
  • (1S,8R,9R,10R)-3,4,13,14,15-pentamethoxy-8,9-dimethyl-17-oxatetracyclo[8.6.1.01,6.011,16]heptadeca-3,5,11,13,15-pentaen-2-one
Other name (3)：
  • 5,6,7,8-Tetrahydro-12H-5α,12aα-epoxy-1,2,3,10,11-pentamethoxy-6α,7α-dimethyldibenzo[a,c]cyclooctene-12-one
  • カズラリグナンD
  • Kadsuralignan D
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