Chem
J-GLOBAL ID：200907072683448207   Nikkaji number：J2.587.791H

Uroleuconaphin B2b

ウロロイコナフィンB2b
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： C30H28O12
Molecular formula furigana： C30-H28-O12
Molecular weight： 580.542
InChI： InChI=1S/C30H28O12/c1-8-17-23(24(35)10(3)39-8)30-22-19(25(17)36)15(33)7-16(34)21(22)28(38)13-5-12(31)6-14(32)18(13)26(37)20-9(2)40-11(4)27(41-30)29(20,28)42-30/h5-11,20,24,27,31-35,38H,1-4H3/t8-,9-,10-,11-,20-,24-,27-,28+,29+,30-/m1/s1
InChI key： WVOUFVZPYDDKNK-GQOXPQIOSA-N
SMILES： C[C@H]1O[C@H](C)[C@@H]2C(=O)c3c(O)cc(O)cc3[C@]3(O)c4c(O)cc(O)c5C(=O)C6=C([C@H](O)[C@@H](C)O[C@@H]6C)[C@@]6(O[C@H]1[C@@]23O6)c45
Systematic name  (3)：
  • (1R)-1β,1′β,3α,3′α-テトラメチル-4′β,5,7,7′,9,9′-ヘキサヒドロキシ-4β,5′β:4aβ,5′-ジエポキシ-3,3′,4,4a,4′,5,5′,10,10aα,10′-デカヒドロ-5β,6′-ビ[1H-ナフト[2,3-c]ピラン]-10,10′-ジオン
  • (1R,3S,4R,5R,7R,8S,16S,24R,26R,27S)-11,13,16,18,20,27-ヘキサヒドロキシ-5,7,24,26-テトラメチル-2,6,25,30-テトラオキサオクタシクロ[15.11.1.11,4.03,8.03,16.010,15.021,29.023,28]トリアコンタ-10,12,14,17,19,21(29),23(28)-ヘプタエン-9,22-ジオン
  • (1R,3S,4R,5R,7R,8S,16S,24R,26R,27S)-11,13,16,18,20,27-hexahydroxy-5,7,24,26-tetramethyl-2,6,25,30-tetraoxaoctacyclo[15.11.1.11,4.03,8.03,16.010,15.021,29.023,28]triaconta-10,12,14,17,19,21(29),23(28)-heptaene-9,22-dione
Other name (3)：
  • (1R)-1β,1′β,3α,3′α-Tetramethyl-4′β,5,7,7′,9,9′-hexahydroxy-4β,5′β:4aβ,5′-diepoxy-3,3′,4,4a,4′,5,5′,10,10aα,10′-decahydro-5β,6′-bi[1H-naphtho[2,3-c]pyran]-10,10′-dione
  • ウロロイコナフィンB2b
  • Uroleuconaphin B2b
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