Chem
J-GLOBAL ID:200907062593803134
Nikkaji number:J17.616H
Histrionicotoxin
ヒストリオニコトキシン
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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:
C19 H25 NO
Molecular formula furigana:
C19-H25-N-O
Molecular weight:
283.415
InChI:
InChI=1S/C19H25NO/c1-3-5-7-10-16-11-8-14-19(20-16)15-9-13-18(21)17(19)12-6-4-2/h1-2,5-7,12,16-18,20-21H,8-11,13-15H2/b7-5-,12-6-/t16-,17-,18+,19-/m1/s1
InChI key:
JBRYWENFVHQBGY-AFVFYVOOSA-N
SMILES:
O[C@H]1CCC[C@]2(CCC[C@@H](C/C=C\C#C)N2)[C@@H]1/C=C\C#C
Systematic name (4):
(2S,6R)-7α-[(Z)-1-ブテン-3-イニル]-2-[(Z)-2-ペンテン-4-イニル]-1-アザスピロ[5.5]ウンデカン-8β-オール
(2S,6R)-2α-[(Z)-2-ペンテン-4-イニル]-7α-[(Z)-1-ブテン-3-イニル]-1-アザスピロ[5.5]ウンデカン-8β-オール
(2S,6R,7S,8S)-7-[(1Z)-ブタ-1-エン-3-イン-1-イル]-2-[(2Z)-ペンタ-2-エン-4-イン-1-イル]-1-アザスピロ[5.5]ウンデカン-8-オール
(2S,6R,7S,8S)-7-[(1Z)-but-1-en-3-yn-1-yl]-2-[(2Z)-pent-2-en-4-yn-1-yl]-1-azaspiro[5.5]undecan-8-ol
Other name (6):
ヒストリオニコトキシン
Histrionicotoxin
(2S,6R)-7α-[(Z)-1-Buten-3-ynyl]-2-[(Z)-2-penten-4-ynyl]-1-azaspiro[5.5]undecan-8β-ol
(2S,6R)-2α-[(Z)-2-Pentene-4-ynyl]-7α-[(Z)-1-butene-3-ynyl]-1-azaspiro[5.5]undecane-8β-ol
(-)-ヒストリオニコトキシン
(-)-Histrionicotoxin
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CAS registry number:
34272-51-0
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