Chem
J-GLOBAL ID:200907088826846008
Nikkaji number:J1.175.728F
(2R,5S)-4,4′aα,5,5′,8′,8′a-Hexahydro-2′,5,5′,5′,8′aβ-pentamethylspiro[furan-2(3H),1′(4′H)-naphthalene]-5-acetic acid methyl ester
(2R,5S)-4,4′aα,5,5′,8′,8′a-ヘキサヒドロ-2′,5,5′,5′,8′aβ-ペンタメチルスピロ[フラン-2(3H),1′(4′H)-ナフタレン]-5-酢酸メチル
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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:
C21 H32 O3
Molecular formula furigana:
C21-H32-O3
Molecular weight:
332.484
InChI:
InChI=1S/C21H32O3/c1-15-8-9-16-18(2,3)10-7-11-20(16,5)21(15)13-12-19(4,24-21)14-17(22)23-6/h7-8,10,16H,9,11-14H2,1-6H3/t16-,19-,20-,21+/m0/s1
InChI key:
YVKINSVYYITMGX-LRGNLBRXSA-N
SMILES:
COC(=O)C[C@]1(C)CC[C@@]2(O1)C(=CC[C@H]1C(C)(C)C=CC[C@]21C)C
Systematic name (3):
(2R,5S)-4,4′aα,5,5′,8′,8′a-ヘキサヒドロ-2′,5,5′,5′,8′aβ-ペンタメチルスピロ[フラン-2(3H),1′(4′H)-ナフタレン]-5-酢酸メチル
メチル 2-[(1R,4aS,5'S,8aS)-2,5,5,5',8a-ペンタメチル-4a,5,8,8a-テトラヒドロ-4H-スピロ[ナフタレン-1,2'-オキソラン]-5'-イル]アセタート
methyl 2-[(1R,4aS,5'S,8aS)-2,5,5,5',8a-pentamethyl-4a,5,8,8a-tetrahydro-4H-spiro[naphthalene-1,2'-oxolan]-5'-yl]acetate
Other name (1):
(2R,5S)-4,4′aα,5,5′,8′,8′a-Hexahydro-2′,5,5′,5′,8′aβ-pentamethylspiro[furan-2(3H),1′(4′H)-naphthalene]-5-acetic acid methyl ester
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