Chem
J-GLOBAL ID：201607018371579372   Nikkaji number：J3.500.261H

(2S,3R,4R,6E,12E)-2-Amino-3,4-dihydroxy-2-(hydroxymethyl)-14-oxoicosa-6,12-dienoic acid

(2S,3R,4R,6E,12E)-2-アミノ-3,4-ジヒドロキシ-2-(ヒドロキシメチル)-14-オキソイコサ-6,12-ジエン酸
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： C21H37NO6
Molecular formula furigana： C21-H37-N-O6
Molecular weight： 399.528
InChI： InChI=1S/C21H37NO6/c1-2-3-4-10-13-17(24)14-11-8-6-5-7-9-12-15-18(25)19(26)21(22,16-23)20(27)28/h9,11-12,14,18-19,23,25-26H,2-8,10,13,15-16,22H2,1H3,(H,27,28)/b12-9+,14-11+/t18-,19+,21+/m1/s1
InChI key： AHRPEPPVBKPDJQ-LEBSLOHFSA-N
SMILES： CCCCCCC(=O)/C=C/CCCC/C=C/C[C@@H](O)[C@H](O)[C@@](N)(CO)C(=O)O
Systematic name  (2)：
  • (2S,3R,4R,6E,12E)-2-アミノ-3,4-ジヒドロキシ-2-(ヒドロキシメチル)-14-オキソイコサ-6,12-ジエン酸
  • (2S,3R,4R,6E,12E)-2-amino-3,4-dihydroxy-2-(hydroxymethyl)-14-oxoicosa-6,12-dienoic acid
Other name (1)：
  • (2S,3R,4R,6E,12E)-2-Amino-3,4-dihydroxy-2-(hydroxymethyl)-14-oxoicosa-6,12-dienoic acid
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