Chem
J-GLOBAL ID:200907017841767659
Nikkaji number:J2.144.281J
(2S,3R)-2-Azido-4-icosene-1,3-diol 3-benzoate
(2S,3R)-2-アジド-4-イコセン-1,3-ジオール3-ベンゾアート
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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:
C27 H43 N[N-][N+]O3
Molecular formula furigana:
C27-H43-N3-O3
Molecular weight:
457.659
InChI:
InChI=1S/C27H43N3O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-26(25(23-31)29-30-28)33-27(32)24-20-17-16-18-21-24/h16-22,25-26,31H,2-15,23H2,1H3/t25-,26+/m0/s1
InChI key:
SVAMCLJCXVYFPB-IZZNHLLZSA-N
SMILES:
CCCCCCCCCCCCCCCC=C[C@@H](OC(=O)c1ccccc1)[C@H](CO)N=[N+]=[N-]
Systematic name (3):
(2S,3R)-2-アジド-4-イコセン-1,3-ジオール3-ベンゾアート
(2S,3R)-2-アジド-1-ヒドロキシイコサ-4-エン-3-イル ベンゾアート
(2S,3R)-2-azido-1-hydroxyicos-4-en-3-yl benzoate
Other name (1):
(2S,3R)-2-Azido-4-icosene-1,3-diol 3-benzoate
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