Chem
J-GLOBAL ID:201207085686129986
Nikkaji number:J3.043.803E
(4S,5R)-1-(4-Methoxybenzyloxy)-5-nitroocta-2,7-diene-4-ol
(4S,5R)-1-(4-メトキシベンジルオキシ)-5-ニトロオクタ-2,7-ジエン-4-オール
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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:
C16 H21 [N+]O4 [O-]
Molecular formula furigana:
C16-H21-N-O5
Molecular weight:
307.346
InChI:
InChI=1S/C16H21NO5/c1-3-5-15(17(19)20)16(18)6-4-11-22-12-13-7-9-14(21-2)10-8-13/h3-4,6-10,15-16,18H,1,5,11-12H2,2H3/t15-,16+/m1/s1
InChI key:
VKBPREHKZKOMRW-CVEARBPZSA-N
SMILES:
COc1ccc(COCC=C[C@H](O)[C@@H](CC=C)[N+](=O)[O-])cc1
Systematic name (3):
(4S,5R)-1-(4-メトキシベンジルオキシ)-5-ニトロオクタ-2,7-ジエン-4-オール
(4S,5R)-1-[(4-メトキシフェニル)メトキシ]-5-ニトロオクタ-2,7-ジエン-4-オール
(4S,5R)-1-[(4-methoxyphenyl)methoxy]-5-nitroocta-2,7-dien-4-ol
Other name (1):
(4S,5R)-1-(4-Methoxybenzyloxy)-5-nitroocta-2,7-diene-4-ol
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