Chem
J-GLOBAL ID：200907017042444731   Nikkaji number：J1.904.362B

Uroleuconaphin A1

ウロロイコナフィンA1
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： C30H28O11
Molecular formula furigana： C30-H28-O11
Molecular weight： 564.543
InChI： InChI=1S/C30H28O11/c1-9-5-14-19(10(2)39-9)26(35)21-17(33)8-18-24(22(21)25(14)34)29(38)15-6-13(31)7-16(32)20(15)27(36)23-11(3)40-12(4)28(37)30(23,29)41-18/h6-12,23,28,31-33,37-38H,5H2,1-4H3/t9-,10-,11-,12-,23-,28-,29+,30+/m1/s1
InChI key： PALHHCRJJXZADT-LISLSUEVSA-N
SMILES： C[C@@H]1CC2=C([C@@H](C)O1)C(=O)c1c(O)cc3O[C@]45[C@H](O)[C@@H](C)O[C@H](C)[C@@H]4C(=O)c4c(O)cc(O)cc4[C@]5(O)c3c1C2=O
Systematic name  (5)：
  • (3S,4R,8β)-4α,11,13,16β,28-ペンタヒドロキシ-5β,7α,22β,24α-テトラメチル-2,6,23-トリオキサヘプタシクロ[15.12.0.03,8.03,16.010,15.018,27.020,25]ノナコサン-1(17),10(15),11,13,18(27),20(25),28-ヘプタエン-9,19,26-トリオン
  • (1R)-1β,1′β,3α,3′α-テトラメチル-4′β,5′,7′,9,9′-ペンタヒドロキシ-4′aβ,7-オキシ-3,3′,4,4′,4′a,5,5′,10,10′,10′aα-デカヒドロ-6,5′β-ビ[1H-ナフト[2,3-c]ピラン]-5,10,10′-トリオン
  • (1R)-1β,3α-ジメチル-4β,5,7,9-テトラヒドロキシ-4aβ,5β-[オキシ[(1R,3R)-1,3-ジメチル-5,10-ジオキソ-9-ヒドロキシ-3,4-ジヒドロ-1H-ナフト[2,3-c]ピラン-7,6-ジイル]]-3,4,4a,5,10,10aα-ヘキサヒドロ-1H-ナフト[2,3-c]ピラン-10-オン
  • (1S,9R,11R,17S,25S,26R,28R,29R)-5,17,20,22,29-ペンタヒドロキシ-9,11,26,28-テトラメチル-2,10,27-トリオキサヘプタシクロ[15.12.0.01,25.03,16.06,15.08,13.018,23]ノナコサ-3,5,8(13),15,18,20,22-ヘプタエン-7,14,24-トリオン
  • (1S,9R,11R,17S,25S,26R,28R,29R)-5,17,20,22,29-pentahydroxy-9,11,26,28-tetramethyl-2,10,27-trioxaheptacyclo[15.12.0.01,25.03,16.06,15.08,13.018,23]nonacosa-3,5,8(13),15,18,20,22-heptaene-7,14,24-trione
Other name (9)：
  • (3S,4R,8β)-4α,11,13,16β,28-Pentahydroxy-5β,7α,22β,24α-tetramethyl-2,6,23-trioxaheptacyclo[15.12.0.03,8.03,16.010,15.018,27.020,25]nonacosane-1(17),10(15),11,13,18(27),20(25),28-heptene-9,19,26-trione
  • ロードダクチナフィン-jc-2
  • Rhododactynaphin-jc-2
  • (1R)-1β,1′β,3α,3′α-Tetramethyl-4′β,5′,7′,9,9′-pentahydroxy-4′aβ,7-oxy-3,3′,4,4′,4′a,5,5′,10,10′,10′aα-decahydro-6,5′β-bi[1H-naphtho[2,3-c]pyran]-5,10,10′-trione
  • ロドダクチナフィン-jc-2
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