Chem
J-GLOBAL ID:200907032163252723   Nikkaji number:J48.396F

Harringtonine

ハリングトニン
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: C28H37NO9
Molecular formula furigana: C28-H37-N-O9
Molecular weight: 531.602
InChI: InChI=1S/C28H37NO9/c1-26(2,32)8-9-28(33,15-22(30)35-4)25(31)38-24-21(34-3)14-27-7-5-10-29(27)11-6-17-12-19-20(37-16-36-19)13-18(17)23(24)27/h12-14,23-24,32-33H,5-11,15-16H2,1-4H3/t23-,24-,27+,28-/m1/s1
InChI key: HAVJATCHLFRDHY-KSZYUSJVSA-N
SMILES: COC(=O)C[C@](O)(CCC(C)(C)O)C(=O)O[C@H]1[C@H]2c3cc4OCOc4cc3CCN3CCC[C@]23C=C1OC
Systematic name  (3):
  • (2R)-2-ヒドロキシ-2-(3-ヒドロキシ-3-メチルブチル)ブタン二酸1-[(3S)-3-デオキシセファロタキシン-3-イル]4-メチル
  • (2S,3S,6R)-4-メトキシ-16,18-ジオキサ-10-アザペンタシクロ[11.7.0.02,6.06,10.015,19]イコサ-1(20),4,13,15(19)-テトラエン-3-イル 1-メチル (3R)-3-ヒドロキシ-3-(3-ヒドロキシ-3-メチルブチル)ブタンジオアート
  • (2S,3S,6R)-4-methoxy-16,18-dioxa-10-azapentacyclo[11.7.0.02,6.06,10.015,19]icosa-1(20),4,13,15(19)-tetraen-3-yl 1-methyl (3R)-3-hydroxy-3-(3-hydroxy-3-methylbutyl)butanedioate
Other name (7):
  • Harringtonine
  • Harringtonin
  • ハリングトニン
  • 2-Hydroxy-2-(3-hydroxy-3-methylbutyl)butanedioic acid 1-[(3R)-3-deoxycephalotaxin-3-yl]4-methyl ester
  • ハリントニン
Show all
CAS registry number: 26833-85-2
Regulation number (1):
  • FK0250000
KEGG COMPOUND: C10597
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