Chem
J-GLOBAL ID:201007084619103513   Nikkaji number:J2.850.377F

Anthenoside F

アンテノシドF
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: C42H70O14
Molecular formula furigana: C42-H70-O14
Molecular weight: 799.008
InChI: InChI=1S/C42H70O14/c1-19(2)20(3)9-10-21(4)30-26(16-24-29-23(12-14-42(24,30)6)41(5)13-11-22(43)15-25(41)31(44)34(29)47)53-40-37(50)38(33(46)28(55-40)18-52-8)56-39-36(49)35(48)32(45)27(54-39)17-51-7/h19,21-23,25-28,30-40,43-50H,3,9-18H2,1-2,4-8H3/t21-,22+,23+,25-,26-,27-,28-,30+,31+,32+,33+,34-,35+,36-,37-,38+,39+,40-,41-,42+/m1/s1
InChI key: OWOXXBQOJUAVKG-KTUXWMNOSA-N
SMILES: COC[C@H]1O[C@@H](O[C@H]2[C@@H](O)[C@@H](COC)O[C@@H](O[C@@H]3CC4=C5[C@@H](O)[C@@H](O)[C@H]6C[C@@H](O)CC[C@]6(C)[C@H]5CC[C@]4(C)[C@H]3[C@H](C)CCC(=C)C(C)C)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O
Systematic name  (3):
  • 24-メチレン-3β,6β,7β-トリヒドロキシ-16α-[6-O-メチル-3-O-(6-O-メチル-β-D-ガラクトピラノシル)-β-D-ガラクトピラノシルオキシ]-5α-コレスタ-8(14)-エン
  • (2S,3R,4S,5R,6R)-2-{[(2R,3R,4S,5S,6R)-2-{[(1R,2R,4R,5S,5aS,7S,9aR,9bR,11aR)-4,5,7-トリヒドロキシ-9a,11a-ジメチル-1-[(2R)-6-メチル-5-メチリデンヘプタン-2-イル]-1H,2H,3H,4H,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-2-イル]オキシ}-3,5-ジヒドロキシ-6-(メトキシメチル)オキサン-4-イル]オキシ}-6-(メトキシメチル)オキサン-3,4,5-トリオール
  • (2S,3R,4S,5R,6R)-2-{[(2R,3R,4S,5S,6R)-2-{[(1R,2R,4R,5S,5aS,7S,9aR,9bR,11aR)-4,5,7-trihydroxy-9a,11a-dimethyl-1-[(2R)-6-methyl-5-methylideneheptan-2-yl]-1H,2H,3H,4H,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-2-yl]oxy}-3,5-dihydroxy-6-(methoxymethyl)oxan-4-yl]oxy}-6-(methoxymethyl)oxane-3,4,5-triol
Other name (3):
  • 24-Methylene-3β,6β,7β-trihydroxy-16α-[6-O-methyl-3-O-(6-O-methyl-β-D-galactopyranosyl)-β-D-galactopyranosyloxy]-5α-cholesta-8(14)-ene
  • Anthenoside F
  • アンテノシドF
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