Chem
J-GLOBAL ID:200907001451070882
Nikkaji number:J958.132D
(2R)-N-[(1S,2R)-1-(Hydroxymethyl)-2-hydroxy-3,7,9-heptadecatrienyl]-2-hydroxy-15-methyl-3-octadecenamide
(2R)-N-[(2S,3R)-1,3-ジヒドロキシオクタデカ-4,8,10-トリエン-2-イル]-2-ヒドロキシ-15-メチルオクタデカ-3-エンアミド
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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:
C37 H67 NO4
Molecular formula furigana:
C37-H67-N-O4
Molecular weight:
589.946
InChI:
InChI=1S/C37H67NO4/c1-4-6-7-8-9-10-11-12-13-17-20-23-26-30-35(40)34(32-39)38-37(42)36(41)31-27-24-21-18-15-14-16-19-22-25-29-33(3)28-5-2/h11-13,17,26-27,30-31,33-36,39-41H,4-10,14-16,18-25,28-29,32H2,1-3H3,(H,38,42)/t33?,34-,35+,36+/m0/s1
InChI key:
LPPMUEMMIPAVTE-QMYLHGGXSA-N
SMILES:
CCCCCCCC=CC=CCCC=C[C@@H](O)[C@H](CO)NC(=O)[C@H](O)C=CCCCCCCCCCCC(C)CCC
Systematic name (3):
(2R)-N-[(1S,2R)-1-(ヒドロキシメチル)-2-ヒドロキシ-3,7,9-ヘプタデカトリエニル]-2-ヒドロキシ-15-メチル-3-オクタデセンアミド
(2R)-N-[(2S,3R)-1,3-ジヒドロキシオクタデカ-4,8,10-トリエン-2-イル]-2-ヒドロキシ-15-メチルオクタデカ-3-エンアミド
(2R)-N-[(2S,3R)-1,3-dihydroxyoctadeca-4,8,10-trien-2-yl]-2-hydroxy-15-methyloctadec-3-enamide
Other name (1):
(2R)-N-[(1S,2R)-1-(Hydroxymethyl)-2-hydroxy-3,7,9-heptadecatrienyl]-2-hydroxy-15-methyl-3-octadecenamide
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