Chem
J-GLOBAL ID:201407066323353027   Nikkaji number:J3.325.673F

(R)-3-[[(R)-α-Methylbenzyl]benzylamino]-3-[(4R)-2,2-dimethyl-5α-[(benzyloxy)methyl]-1,3-dioxolane-4α-yl]propanoic acid tert-butyl ester

(R)-3-[[(R)-α-メチルベンジル]ベンジルアミノ]-3-[(4R)-2,2-ジメチル-5α-[(ベンジルオキシ)メチル]-1,3-ジオキソラン-4α-イル]プロパン酸tert-ブチル
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: C35H45NO5
Molecular formula furigana: C35-H45-N-O5
Molecular weight: 559.747
InChI: InChI=1S/C35H45NO5/c1-26(29-20-14-9-15-21-29)36(23-27-16-10-7-11-17-27)30(22-32(37)40-34(2,3)4)33-31(39-35(5,6)41-33)25-38-24-28-18-12-8-13-19-28/h7-21,26,30-31,33H,22-25H2,1-6H3/t26-,30-,31+,33-/m1/s1
InChI key: DKOLVIXGVUEJLI-VBHBOUBHSA-N
SMILES: C[C@@H](N(Cc1ccccc1)[C@H](CC(=O)OC(C)(C)C)[C@H]1OC(C)(C)O[C@H]1COCc1ccccc1)c1ccccc1
Systematic name  (3):
  • (R)-3-[[(R)-α-メチルベンジル]ベンジルアミノ]-3-[(4R)-2,2-ジメチル-5α-[(ベンジルオキシ)メチル]-1,3-ジオキソラン-4α-イル]プロパン酸tert-ブチル
  • tert-ブチル (3R)-3-{ベンジル[(1R)-1-フェニルエチル]アミノ}-3-[(4R,5S)-5-[(ベンジルオキシ)メチル]-2,2-ジメチル-1,3-ジオキソラン-4-イル]プロパノアート
  • tert-butyl (3R)-3-{benzyl[(1R)-1-phenylethyl]amino}-3-[(4R,5S)-5-[(benzyloxy)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]propanoate
Other name (1):
  • (R)-3-[[(R)-α-Methylbenzyl]benzylamino]-3-[(4R)-2,2-dimethyl-5α-[(benzyloxy)methyl]-1,3-dioxolane-4α-yl]propanoic acid tert-butyl ester
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