Chem
J-GLOBAL ID:201707018631768759
Nikkaji number:J3.645.791K
3-(2-Hydroxyethylamino)-5-(hydroxymethyl)-5-hydroxy-2-methoxy-2-cyclohexene-1-one
3-(2-ヒドロキシエチルアミノ)-5-(ヒドロキシメチル)-5-ヒドロキシ-2-メトキシ-2-シクロヘキセン-1-オン
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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:
C10 H17 NO5
Molecular formula furigana:
C10-H17-N-O5
Molecular weight:
231.248
InChI:
InChI=1S/C10H17NO5/c1-16-9-7(11-2-3-12)4-10(15,6-13)5-8(9)14/h11-13,15H,2-6H2,1H3
InChI key:
YDDMNIUVPXFVHD-UHFFFAOYSA-N
SMILES:
COC1=C(CC(O)(CO)CC1=O)NCCO
Systematic name (3):
3-(2-ヒドロキシエチルアミノ)-5-(ヒドロキシメチル)-5-ヒドロキシ-2-メトキシ-2-シクロヘキセン-1-オン
5-ヒドロキシ-3-[(2-ヒドロキシエチル)アミノ]-5-(ヒドロキシメチル)-2-メトキシシクロヘキサ-2-エン-1-オン
5-hydroxy-3-[(2-hydroxyethyl)amino]-5-(hydroxymethyl)-2-methoxycyclohex-2-en-1-one
Other name (1):
3-(2-Hydroxyethylamino)-5-(hydroxymethyl)-5-hydroxy-2-methoxy-2-cyclohexene-1-one
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