Chem
J-GLOBAL ID:200907093422806448
Nikkaji number:J1.679.689A
(1R,2R,5E,8E)-2-[(1S)-1,5-Dimethyl-4-hexenyl]-5-methyl-11-oxabicyclo[7.3.0]dodeca-5,8-diene-10-one
(1R,2R,5E,8E)-2-[(1S)-1,5-ジメチル-4-ヘキセニル]-5-メチル-11-オキサビシクロ[7.3.0]ドデカ-5,8-ジエン-10-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:
C20 H30 O2
Molecular formula furigana:
C20-H30-O2
Molecular weight:
302.458
InChI:
InChI=1S/C20H30O2/c1-14(2)7-5-9-16(4)17-12-11-15(3)8-6-10-18-19(17)13-22-20(18)21/h7-8,10,16-17,19H,5-6,9,11-13H2,1-4H3/b15-8+,18-10-/t16-,17+,19+/m0/s1
InChI key:
NXLGBKUVXJCGJY-GWDPEVEDSA-N
SMILES:
C[C@@H](CCC=C(C)C)[C@H]1CC/C(=C/C/C=C\2/[C@@H]1COC2=O)/C
Systematic name (1):
(1R,2R,5E,8E)-2-[(1S)-1,5-ジメチル-4-ヘキセニル]-5-メチル-11-オキサビシクロ[7.3.0]ドデカ-5,8-ジエン-10-オン
Other name (1):
(1R,2R,5E,8E)-2-[(1S)-1,5-Dimethyl-4-hexenyl]-5-methyl-11-oxabicyclo[7.3.0]dodeca-5,8-diene-10-one
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