Chem
J-GLOBAL ID:200907031059347880
Nikkaji number:J336.187J
Axinyssasterol
アキシニッサステロール
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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:
C31 H52 O
Molecular formula furigana:
C31-H52-O
Molecular weight:
440.756
InChI:
InChI=1S/C31H52O/c1-20(2)25(29(4,5)6)12-9-21(3)26-13-14-27-24-11-10-22-19-23(32)15-17-30(22,7)28(24)16-18-31(26,27)8/h10,21,23-28,32H,1,9,11-19H2,2-8H3/t21-,23+,24+,25?,26-,27+,28+,30+,31-/m1/s1
InChI key:
XSDDNSUCLCIHER-PIANLKICSA-N
SMILES:
C[C@H](CCC(C(=C)C)C(C)(C)C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
Systematic name (6):
(24ξ)-24-(1-メチルエテニル)-25-メチルコレステロール
24-イソプロペニル-25-メチルコレスタ-5-エン-3β-オール
24ξ-イソプロペニル-25-メチルコレスタ-5-エン-3β-オール
(24ξ)-28,28-ジメチルスチグマスタ-5,25-ジエン-3β-オール
(1R,3aS,3bS,7S,9aR,9bS,11aR)-1-[(2R)-5-tert-ブチル-6-メチルヘプタ-6-エン-2-イル]-9a,11a-ジメチル-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)-5-tert-butyl-6-methylhept-6-en-2-yl]-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol
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Other name (6):
CAS registry number:
86105-68-2
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