Chem
J-GLOBAL ID:200907025210359780
Nikkaji number:J2.158.089I
(7S)-9α-(3-Hydroxy-4-methoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane-7α-(1-butanol)
(7S)-9α-(3-ヒドロキシ-4-メトキシフェニル)-1,4-ジオキサ-8-アザスピロ[4.5]デカン-7α-(1-ブタノール)
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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:
C18 H27 NO5
Molecular formula furigana:
C18-H27-N-O5
Molecular weight:
337.416
InChI:
InChI=1S/C18H27NO5/c1-22-17-6-5-13(10-16(17)21)15-12-18(23-8-9-24-18)11-14(19-15)4-2-3-7-20/h5-6,10,14-15,19-21H,2-4,7-9,11-12H2,1H3/t14-,15-/m0/s1
InChI key:
QHNWGBTZPYXKSK-GJZGRUSLSA-N
SMILES:
COc1ccc(cc1O)[C@@H]1CC2(C[C@H](CCCCO)N1)OCCO2
Systematic name (3):
(7S)-9α-(3-ヒドロキシ-4-メトキシフェニル)-1,4-ジオキサ-8-アザスピロ[4.5]デカン-7α-(1-ブタノール)
5-[(7S,9S)-9-(4-ヒドロキシブチル)-1,4-ジオキサ-8-アザスピロ[4.5]デカン-7-イル]-2-メトキシフェノール
5-[(7S,9S)-9-(4-hydroxybutyl)-1,4-dioxa-8-azaspiro[4.5]decan-7-yl]-2-methoxyphenol
Other name (1):
(7S)-9α-(3-Hydroxy-4-methoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane-7α-(1-butanol)
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