Chem
J-GLOBAL ID:200907000309902017
Nikkaji number:J2.594.820C
(2R,3R,4S)-2,4-Dimethyl-3-(4-methoxybenzyloxy)decanoic acid
(2R,3R,4S)-2,4-ジメチル-3-(4-メトキシベンジルオキシ)デカン酸
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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 H32 O4
Molecular formula furigana:
C20-H32-O4
Molecular weight:
336.472
InChI:
InChI=1S/C20H32O4/c1-5-6-7-8-9-15(2)19(16(3)20(21)22)24-14-17-10-12-18(23-4)13-11-17/h10-13,15-16,19H,5-9,14H2,1-4H3,(H,21,22)/t15-,16+,19+/m0/s1
InChI key:
KPQJTIQVKMOGEU-FRQCXROJSA-N
SMILES:
CCCCCC[C@H](C)[C@@H](OCc1ccc(OC)cc1)[C@@H](C)C(=O)O
Systematic name (3):
(2R,3R,4S)-2,4-ジメチル-3-(4-メトキシベンジルオキシ)デカン酸
(2R,3R,4S)-3-[(4-メトキシフェニル)メトキシ]-2,4-ジメチルデカン酸
(2R,3R,4S)-3-[(4-methoxyphenyl)methoxy]-2,4-dimethyldecanoic acid
Other name (1):
(2R,3R,4S)-2,4-Dimethyl-3-(4-methoxybenzyloxy)decanoic acid
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