Chem
J-GLOBAL ID:200907042121460143   Nikkaji number:J17.393B

Nic-17

(22R)-6α,7α-エポキシ-5,22-ジヒドロキシ-D(17a)-ホモ-18,26,27-トリノル-5α-コレスタ-2,13,15,17-テトラエン-1,24-ジオン
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: C25H30O5
Molecular formula furigana: C25-H30-O5
Molecular weight: 410.510
InChI: InChI=1S/C25H30O5/c1-13(26)11-19(27)14(2)15-6-8-17-16(12-15)7-9-18-21(17)22-23(30-22)25(29)10-4-5-20(28)24(18,25)3/h4-6,8,12,14,18-19,21-23,27,29H,7,9-11H2,1-3H3/t14-,18-,19+,21-,22-,23-,24-,25-/m0/s1
InChI key: UPPPRUGHDBCPEF-FXHGRHHISA-N
SMILES: C[C@H]([C@H](O)CC(=O)C)c1ccc2[C@@H]3[C@@H]4O[C@@H]4[C@@]4(O)CC=CC(=O)[C@]4(C)[C@H]3CCc2c1
Systematic name  (3):
  • (22R)-6α,7α-エポキシ-5,22-ジヒドロキシ-D(17a)-ホモ-18,26,27-トリノル-5α-コレスタ-2,13,15,17-テトラエン-1,24-ジオン
  • (1aS,1bR,5aR,5bS,11bR,11cS)-1b-ヒドロキシ-9-[(2S,3R)-3-ヒドロキシ-5-オキソヘキサン-2-イル]-5a-メチル-1aH,1bH,2H,5H,5aH,5bH,6H,7H,11bH,11cH-クリセノ[5,6-b]オキシレン-5-オン
  • (1aS,1bR,5aR,5bS,11bR,11cS)-1b-hydroxy-9-[(2S,3R)-3-hydroxy-5-oxohexan-2-yl]-5a-methyl-1aH,1bH,2H,5H,5aH,5bH,6H,7H,11bH,11cH-chryseno[5,6-b]oxiren-5-one
Other name (2):
  • Nic-17
  • (22R)-6α,7α-Epoxy-5,22-dihydroxy-D(17a)-homo-18,26,27-trinor-5α-cholesta-2,13,15,17-tetrene-1,24-dione
CAS registry number: 40071-63-4
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