Chem
J-GLOBAL ID:200907098494049724   Nikkaji number:J292.892B

Digoxigenin monodigitoxoside

ジゴキシゲニンモノジギトキソシド
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: C29H44O8
Molecular formula furigana: C29-H44-O8
Molecular weight: 520.663
InChI: InChI=1S/C29H44O8/c1-15-26(33)22(30)13-25(36-15)37-18-6-8-27(2)17(11-18)4-5-20-21(27)12-23(31)28(3)19(7-9-29(20,28)34)16-10-24(32)35-14-16/h10,15,17-23,25-26,30-31,33-34H,4-9,11-14H2,1-3H3/t15-,17-,18+,19-,20-,21+,22+,23-,25+,26-,27+,28+,29+/m1/s1
InChI key: JFSXBMIFXZFKHD-ZDDLGXCGSA-N
SMILES: C[C@H]1O[C@H](C[C@H](O)[C@@H]1O)O[C@H]1CC[C@@]2(C)[C@H](CC[C@@H]3[C@@H]2C[C@@H](O)[C@]2(C)[C@H](CC[C@]32O)C2=CC(=O)OC2)C1
Systematic name  (7):
  • 3β-[(2,6-ジデオキシ-β-D-ribo-ヘキソピラノシル)オキシ]-12β,14-ジヒドロキシ-5β,14β-カルダ-20(22)-エノリド
  • 3β-[(2,6-ジデオキシ-β-D-ribo-ヘキソピラノシル)オキシ]-12β,14-ジヒドロキシ-5β-カルダ-20(22)-エノリド
  • 3β-(2,6-ジデオキシ-β-D-ribo-ヘキソピラノシルオキシ)-12β,14-ジヒドロキシ-5β-カルダ-20(22)-エノリド
  • 3β-(2,6-ジデオキシ-β-D-ribo-ヘキソピラノシルオキシ)-12β,14-ジヒドロキシ-5β,14β-カルダ-20(22)-エノリド
  • 12β,14β-ジヒドロキシ-5β-カルダ-20(22)-エノリド-3β-イル2,6-ジデオキシ-β-D-アルトロピラノシド
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Other name (9):
  • ジゴキシゲニンモノジギトキソシド
  • Digoxigenin monodigitoxoside
  • 3β-[(2,6-Dideoxy-β-D-ribo-hexopyranosyl)oxy]-12β,14-dihydroxy-5β,14β-card-20(22)-enolide
  • 3β-[(2,6-Dideoxy-β-D-ribo-hexopyranosyl)oxy]-12β,14-dihydroxy-5β-carda-20(22)-enolide
  • 3β-(2,6-Dideoxy-β-D-ribo-hexopyranosyloxy)-12β,14-dihydroxy-5β-carda-20(22)-enolide
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CAS registry number: 5352-63-6
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