Chem
J-GLOBAL ID:200907023734392642
Nikkaji number:J2.459.261H
6α-(Dodecylamino)-4-(hydroxymethyl)-4-cyclohexene-1α,2β,3α-triol
6α-(ドデシルアミノ)-4-(ヒドロキシメチル)-4-シクロヘキセン-1α,2β,3α-トリオール
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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 H37 NO4
Molecular formula furigana:
C19-H37-N-O4
Molecular weight:
343.508
InChI:
InChI=1S/C19H37NO4/c1-2-3-4-5-6-7-8-9-10-11-12-20-16-13-15(14-21)17(22)19(24)18(16)23/h13,16-24H,2-12,14H2,1H3/t16-,17+,18-,19-/m0/s1
InChI key:
FADXCMZSAYFOFY-RDGPPVDQSA-N
SMILES:
CCCCCCCCCCCCN[C@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name (3):
6α-(ドデシルアミノ)-4-(ヒドロキシメチル)-4-シクロヘキセン-1α,2β,3α-トリオール
(1S,2S,3R,6S)-6-(ドデシルアミノ)-4-(ヒドロキシメチル)シクロヘキサ-4-エン-1,2,3-トリオール
(1S,2S,3R,6S)-6-(dodecylamino)-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol
Other name (1):
6α-(Dodecylamino)-4-(hydroxymethyl)-4-cyclohexene-1α,2β,3α-triol
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