Chem
J-GLOBAL ID:200907007299972326
Nikkaji number:J19.364J
Buddledin B
ブッドレジンB
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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:
C15 H22 O2
Molecular formula furigana:
C15-H22-O2
Molecular weight:
234.339
InChI:
InChI=1S/C15H22O2/c1-9-6-5-7-10(2)13(16)14(17)12-11(9)8-15(12,3)4/h7,11-12,14,17H,1,5-6,8H2,2-4H3/b10-7+/t11-,12+,14-/m1/s1
InChI key:
AXGJIHAKGFPXOX-BFRHVZAJSA-N
SMILES:
C/C/1=C\CCC(=C)[C@H]2CC(C)(C)[C@@H]2[C@@H](O)C1=O
Systematic name (3):
(1R,2R,4E,9S)-2-ヒドロキシ-4,11,11-トリメチル-8-メチレンビシクロ[7.2.0]ウンデカ-4-エン-3-オン
(1R,2R,4E,9S)-2-ヒドロキシ-4,11,11-トリメチル-8-メチリデンビシクロ[7.2.0]ウンデカ-4-エン-3-オン
(1R,2R,4E,9S)-2-hydroxy-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-en-3-one
Other name (3):
ブッドレジンB
Buddledin B
(1R,2R,4E,9S)-2-Hydroxy-4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-en-3-one
CAS registry number:
62346-21-8
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