Chem
J-GLOBAL ID：200907058906726449   Nikkaji number：J2.077.877F

(1α,5α)-2-(Benzyloxycarbonyl)-4α-(benzyloxymethyl)-4-(mesyloxymethyl)-6β-(benzyloxycarbonylaminomethyl)-2-azabicyclo[3.3.1]nonane

(1α,5α)-2-(ベンジルオキシカルボニル)-4α-(ベンジルオキシメチル)-4-(メシルオキシメチル)-6β-(ベンジルオキシカルボニルアミノメチル)-2-アザビシクロ[3.3.1]ノナン
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： C35H42N2O8S
Molecular formula furigana： C35-H42-N2-O8-S
Molecular weight： 650.790
InChI： InChI=1S/C35H42N2O8S/c1-46(40,41)45-26-35(25-42-21-27-11-5-2-6-12-27)24-37(34(39)44-23-29-15-9-4-10-16-29)31-18-17-30(32(35)19-31)20-36-33(38)43-22-28-13-7-3-8-14-28/h2-16,30-32H,17-26H2,1H3,(H,36,38)/t30-,31-,32-,35-/m1/s1
InChI key： IPOZSAUJSVACRT-XINZFJMUSA-N
SMILES： CS(=O)(=O)OC[C@]1(COCc2ccccc2)CN([C@@H]2CC[C@H](CNC(=O)OCc3ccccc3)[C@H]1C2)C(=O)OCc1ccccc1
Systematic name  (3)：
  • (1α,5α)-2-(ベンジルオキシカルボニル)-4α-(ベンジルオキシメチル)-4-(メシルオキシメチル)-6β-(ベンジルオキシカルボニルアミノメチル)-2-アザビシクロ[3.3.1]ノナン
  • ベンジル (1R,4S,5R,6S)-6-({[(ベンジルオキシ)カルボニル]アミノ}メチル)-4-[(ベンジルオキシ)メチル]-4-[(メタンスルホニルオキシ)メチル]-2-アザビシクロ[3.3.1]ノナン-2-カルボキシラート
  • benzyl (1R,4S,5R,6S)-6-({[(benzyloxy)carbonyl]amino}methyl)-4-[(benzyloxy)methyl]-4-[(methanesulfonyloxy)methyl]-2-azabicyclo[3.3.1]nonane-2-carboxylate
Other name (1)：
  • (1α,5α)-2-(Benzyloxycarbonyl)-4α-(benzyloxymethyl)-4-(mesyloxymethyl)-6β-(benzyloxycarbonylaminomethyl)-2-azabicyclo[3.3.1]nonane
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