Chem
J-GLOBAL ID:200907027560482545   Nikkaji number:J815.383C

1-[5-O-(4-Methoxytrityl)-2,3-dideoxy-3-nitro-β-D-erythro-pentofuranosyl]thymine

1-[5-O-(4-メトキシトリチル)-2,3-ジデオキシ-3-ニトロ-β-D-erythro-ペントフラノシル]チミン
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: C30H29N2[N+]O6[O-]
Molecular formula furigana: C30-H29-N3-O7
Molecular weight: 543.576
InChI: InChI=1S/C30H29N3O7/c1-20-18-32(29(35)31-28(20)34)27-17-25(33(36)37)26(40-27)19-39-30(21-9-5-3-6-10-21,22-11-7-4-8-12-22)23-13-15-24(38-2)16-14-23/h3-16,18,25-27H,17,19H2,1-2H3,(H,31,34,35)/t25-,26+,27+/m0/s1
InChI key: HGGWWXRVDGNAQP-OYUWMTPXSA-N
SMILES: COc1ccc(cc1)C(OC[C@H]1O[C@H](C[C@@H]1[N+](=O)[O-])n1cc(C)c(=O)[nH]c1=O)(c1ccccc1)c1ccccc1
Systematic name  (3):
  • 1-[5-O-(4-メトキシトリチル)-2,3-ジデオキシ-3-ニトロ-β-D-erythro-ペントフラノシル]チミン
  • 1-[(2R,4S,5S)-5-{[(4-メトキシフェニル)ジフェニルメトキシ]メチル}-4-ニトロオキソラン-2-イル]-5-メチル-1,2,3,4-テトラヒドロピリミジン-2,4-ジオン
  • 1-[(2R,4S,5S)-5-{[(4-methoxyphenyl)diphenylmethoxy]methyl}-4-nitrooxolan-2-yl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1):
  • 1-[5-O-(4-Methoxytrityl)-2,3-dideoxy-3-nitro-β-D-erythro-pentofuranosyl]thymine
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