Chem
J-GLOBAL ID:200907002644635697
Nikkaji number:J2.436.690A
(S)-3-Hydroxy-4-pentenoic acid (1R,4R)-1-methyl-4-hydroxy-5-hexenyl ester
(S)-3-ヒドロキシ-4-ペンテン酸(1R,4R)-1-メチル-4-ヒドロキシ-5-ヘキセニル
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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:
C12 H20 O4
Molecular formula furigana:
C12-H20-O4
Molecular weight:
228.288
InChI:
InChI=1S/C12H20O4/c1-4-10(13)7-6-9(3)16-12(15)8-11(14)5-2/h4-5,9-11,13-14H,1-2,6-8H2,3H3/t9-,10+,11-/m1/s1
InChI key:
PPQORSGJANZSAM-OUAUKWLOSA-N
SMILES:
C[C@H](CC[C@@H](O)C=C)OC(=O)C[C@H](O)C=C
Systematic name (3):
(S)-3-ヒドロキシ-4-ペンテン酸(1R,4R)-1-メチル-4-ヒドロキシ-5-ヘキセニル
(2R,5R)-5-ヒドロキシヘプタ-6-エン-2-イル (3S)-3-ヒドロキシペンタ-4-エノアート
(2R,5R)-5-hydroxyhept-6-en-2-yl (3S)-3-hydroxypent-4-enoate
Other name (1):
(S)-3-Hydroxy-4-pentenoic acid (1R,4R)-1-methyl-4-hydroxy-5-hexenyl ester
Thsaurus map:
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