Chem
J-GLOBAL ID:201407029670845816
Nikkaji number:J3.257.088G
(3R)-3β-(1-Ethylpropoxy)-4β-(acetylamino)-5β-amino-1-cyclohexene-1-carboxylic acid
(3R)-3β-(1-エチルプロポキシ)-4β-(アセチルアミノ)-5β-アミノ-1-シクロヘキセン-1-カルボン酸
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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:
C14 H24 N2 O4
Molecular formula furigana:
C14-H24-N2-O4
Molecular weight:
284.356
InChI:
InChI=1S/C14H24N2O4/c1-4-10(5-2)20-12-7-9(14(18)19)6-11(15)13(12)16-8(3)17/h7,10-13H,4-6,15H2,1-3H3,(H,16,17)(H,18,19)/t11-,12+,13-/m0/s1
InChI key:
NENPYTRHICXVCS-XQQFMLRXSA-N
SMILES:
CCC(CC)O[C@@H]1C=C(C[C@H](N)[C@@H]1NC(=O)C)C(=O)O
Systematic name (3):
(3R)-3β-(1-エチルプロポキシ)-4β-(アセチルアミノ)-5β-アミノ-1-シクロヘキセン-1-カルボン酸
(3R,4S,5S)-5-アミノ-4-アセトアミド-3-(ペンタン-3-イルオキシ)シクロヘキサ-1-エン-1-カルボン酸
(3R,4S,5S)-5-amino-4-acetamido-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid
Other name (1):
(3R)-3β-(1-Ethylpropoxy)-4β-(acetylamino)-5β-amino-1-cyclohexene-1-carboxylic acid
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