Chem
J-GLOBAL ID:200907061963304640
Nikkaji number:J1.941.785I
(2R)-2β-(Hydroxymethyl)-3α,5β-dimethyl-6α-(2-methyl-1,3-dioxolane-2-ylmethyl)-1-piperidinecarboxylic acid tert-butyl ester
(2R)-2β-(ヒドロキシメチル)-3α,5β-ジメチル-6α-(2-メチル-1,3-ジオキソラン-2-イルメチル)-1-ピペリジンカルボン酸tert-ブチル
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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 H33 NO5
Molecular formula furigana:
C18-H33-N-O5
Molecular weight:
343.464
InChI:
InChI=1S/C18H33NO5/c1-12-9-13(2)15(11-20)19(16(21)24-17(3,4)5)14(12)10-18(6)22-7-8-23-18/h12-15,20H,7-11H2,1-6H3/t12-,13-,14+,15+/m1/s1
InChI key:
YBQRIGSBVWTXAQ-KBXIAJHMSA-N
SMILES:
C[C@@H]1C[C@@H](C)[C@H](CC2(C)OCCO2)N([C@H]1CO)C(=O)OC(C)(C)C
Systematic name (3):
(2R)-2β-(ヒドロキシメチル)-3α,5β-ジメチル-6α-(2-メチル-1,3-ジオキソラン-2-イルメチル)-1-ピペリジンカルボン酸tert-ブチル
tert-ブチル (2R,3R,5R,6S)-2-(ヒドロキシメチル)-3,5-ジメチル-6-[(2-メチル-1,3-ジオキソラン-2-イル)メチル]ピペリジン-1-カルボキシラート
tert-butyl (2R,3R,5R,6S)-2-(hydroxymethyl)-3,5-dimethyl-6-[(2-methyl-1,3-dioxolan-2-yl)methyl]piperidine-1-carboxylate
Other name (1):
(2R)-2β-(Hydroxymethyl)-3α,5β-dimethyl-6α-(2-methyl-1,3-dioxolane-2-ylmethyl)-1-piperidinecarboxylic acid tert-butyl ester
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