Chem
J-GLOBAL ID:200907000530047520
Nikkaji number:J1.703.971G
(25R)-4,4-Dimethylcholesta-5-ene-3β,26-diol
(25R)-4,4-ジメチルコレスタ-5-エン-3β,26-ジオール
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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:
C29 H50 O2
Molecular formula furigana:
C29-H50-O2
Molecular weight:
430.717
InChI:
InChI=1S/C29H50O2/c1-19(18-30)8-7-9-20(2)22-11-12-23-21-10-13-25-27(3,4)26(31)15-17-29(25,6)24(21)14-16-28(22,23)5/h13,19-24,26,30-31H,7-12,14-18H2,1-6H3/t19-,20-,21+,22-,23+,24+,26+,28-,29-/m1/s1
InChI key:
FLAPPJJSMSEVMY-UUKOSSJBSA-N
SMILES:
C[C@@H](CO)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
Systematic name (3):
(25R)-4,4-ジメチルコレスタ-5-エン-3β,26-ジオール
(1R,3aS,3bS,7S,9aR,9bS,11aR)-1-[(2R,6R)-7-ヒドロキシ-6-メチルヘプタン-2-イル]-6,6,9a,11a-テトラメチル-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-7-オール
(1R,3aS,3bS,7S,9aR,9bS,11aR)-1-[(2R,6R)-7-hydroxy-6-methylheptan-2-yl]-6,6,9a,11a-tetramethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol
Other name (1):
(25R)-4,4-Dimethylcholesta-5-ene-3β,26-diol
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