Chem
J-GLOBAL ID：200907047530368064   Nikkaji number：J2.437.467J

Dysoxylin D

ジソキシリン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： C37H52O10
Molecular formula furigana： C37-H52-O10
Molecular weight： 656.813
InChI： InChI=1S/C37H52O10/c1-18(2)19(3)12-30(42)47-33-31-32-34(6,17-44-31)26(40)15-28(46-21(5)39)37(32,9)25-14-27(45-20(4)38)35(7)23(22-13-29(41)43-16-22)10-11-24(35)36(25,33)8/h11-12,18,22-23,25-28,31-33,40H,10,13-17H2,1-9H3/b19-12+/t22?,23-,25-,26+,27-,28-,31?,32-,33+,34+,35-,36-,37-/m0/s1
InChI key： GWHCYEGDOGSJQJ-CCHXSBGQSA-N
SMILES： CC(C)/C(=C/C(=O)O[C@@H]1C2OC[C@@]3(C)[C@H]2[C@](C)([C@H](C[C@H]3O)OC(=O)C)[C@H]2C[C@H](OC(=O)C)[C@@]3(C)[C@@H](CC=C3[C@]12C)C1COC(=O)C1)/C
Systematic name  (3)：
  • 1,2,3,3a,4,5a,6,6a,8,9,9a,10,11,11aβ,11b,11cβ-ヘキサデカヒドロ-3aα,6aα,9aβ,11bα-テトラメチル-9β-(2-オキソテトラヒドロフラン-4-イル)シクロペンタ[7,8]フェナントロ[10,1-bc]フラン-1β,3β,6β,10β-テトラオール1,10-ジアセタート6-[(E)-3,4-ジメチル-2-ペンテノアート]
  • (1R,2R,4S,5S,6S,10R,11S,15R,16R,18S,19R)-4,18-ビス(アセチルオキシ)-16-ヒドロキシ-1,5,10,15-テトラメチル-6-(5-オキソオキソラン-3-イル)-13-オキサペンタシクロ[10.6.1.02,10.05,9.015,19]ノナデカ-8-エン-11-イル (2E)-3,4-ジメチルペンタ-2-エノアート
  • (1R,2R,4S,5S,6S,10R,11S,15R,16R,18S,19R)-4,18-bis(acetyloxy)-16-hydroxy-1,5,10,15-tetramethyl-6-(5-oxooxolan-3-yl)-13-oxapentacyclo[10.6.1.02,10.05,9.015,19]nonadec-8-en-11-yl (2E)-3,4-dimethylpent-2-enoate
Other name (3)：
  • 1,2,3,3a,4,5a,6,6a,8,9,9a,10,11,11aβ,11b,11cβ-Hexadecahydro-3aα,6aα,9aβ,11bα-tetramethyl-9β-(2-oxotetrahydrofuran-4-yl)cyclopenta[7,8]phenanthro[10,1-bc]furan-1β,3β,6β,10β-tetraol 1,10-diacetate 6-[(E)-3,4-dimethyl-2-pentenoate]
  • ジソキシリンD
  • Dysoxylin D
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