Chem
J-GLOBAL ID:200907008054601353
Nikkaji number:J1.826.487K
(2S,4E,8E,11R,14S)-4,8,14,15,15-Pentamethyl-14-hydroxybicyclo[9.3.1]pentadeca-4,8-diene-2-carboxylic acid 2,14-lactone
(1S,3E,7E,10R,13S)-3,7,13,17,17-ペンタメチル-14-オキサトリシクロ[8.5.2.013,16 ]ヘプタデカ-3,7-ジエン-15-オン
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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:
C21 H32 O2
Molecular formula furigana:
C21-H32-O2
Molecular weight:
316.485
InChI:
InChI=1S/C21H32O2/c1-14-7-6-8-15(2)13-17-18-20(3,4)16(10-9-14)11-12-21(18,5)23-19(17)22/h8-9,16-18H,6-7,10-13H2,1-5H3/b14-9+,15-8+/t16-,17-,18?,21-/m0/s1
InChI key:
CXSAAWIBINQFKR-YZJUELNJSA-N
SMILES:
C/C/1=C\C[C@H]2CC[C@]3(C)OC(=O)[C@@H](C/C(=C/CC1)/C)C3C2(C)C
Systematic name (3):
(2S,4E,8E,11R,14S)-4,8,14,15,15-ペンタメチル-14-ヒドロキシビシクロ[9.3.1]ペンタデカ-4,8-ジエン-2-カルボン酸2,14-ラクトン
(1S,3E,7E,10R,13S)-3,7,13,17,17-ペンタメチル-14-オキサトリシクロ[8.5.2.013,16 ]ヘプタデカ-3,7-ジエン-15-オン
(1S,3E,7E,10R,13S)-3,7,13,17,17-pentamethyl-14-oxatricyclo[8.5.2.013,16 ]heptadeca-3,7-dien-15-one
Other name (1):
(2S,4E,8E,11R,14S)-4,8,14,15,15-Pentamethyl-14-hydroxybicyclo[9.3.1]pentadeca-4,8-diene-2-carboxylic acid 2,14-lactone
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