Chem
J-GLOBAL ID:200907035765178450
Nikkaji number:J2.696.700G
(Z)-3-[3-[(S)-1-Hydroxy-3-methylbutyl]-4-methoxy-6-hydroxyphenyl]propenoic acid
(Z)-3-[3-[(S)-1-ヒドロキシ-3-メチルブチル]-4-メトキシ-6-ヒドロキシフェニル]プロペン酸
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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:
C15 H20 O5
Molecular formula furigana:
C15-H20-O5
Molecular weight:
280.320
InChI:
InChI=1S/C15H20O5/c1-9(2)6-13(17)11-7-10(4-5-15(18)19)12(16)8-14(11)20-3/h4-5,7-9,13,16-17H,6H2,1-3H3,(H,18,19)/b5-4-/t13-/m0/s1
InChI key:
KXEZMFMTEVLUPQ-ZFDPJTLLSA-N
SMILES:
COc1cc(O)c(/C=C\C(=O)O)cc1[C@@H](O)CC(C)C
Systematic name (3):
(Z)-3-[3-[(S)-1-ヒドロキシ-3-メチルブチル]-4-メトキシ-6-ヒドロキシフェニル]プロペン酸
(2Z)-3-{2-ヒドロキシ-5-[(1S)-1-ヒドロキシ-3-メチルブチル]-4-メトキシフェニル}プロパ-2-エン酸
(2Z)-3-{2-hydroxy-5-[(1S)-1-hydroxy-3-methylbutyl]-4-methoxyphenyl}prop-2-enoic acid
Other name (1):
(Z)-3-[3-[(S)-1-Hydroxy-3-methylbutyl]-4-methoxy-6-hydroxyphenyl]propenoic acid
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