Chem
J-GLOBAL ID:201107087087604680
Nikkaji number:J2.891.508J
(1β,4S)-4-(Methoxymethyl)-7-[[(1β,4S)-4-(methoxymethyl)-7-[[(1β,4S)-4-(methoxymethyl)-7-[[(1β,4S)-4-(methoxymethyl)-7-(tert-butyloxycarbonyl)-7-azabicyclo[2.2.1]heptane-2α-yl]carbonyl]-7-azabicyclo[2.2.1]heptane-2α-yl]carbonyl]-7-azabicyclo[2.2.1]heptane-2α-yl]carbonyl]-7-azabicyclo[2.2.1]heptane-2α-carboxylic acid methyl ester
tert-ブチル (1S,3R,4R)-3-[(1S,3R,4R)-3-[(1S,3R,4R)-3-[(1S,3R,4R)-3-(メトキシカルボニル)-1-(メトキシメチル)-7-アザビシクロ[2.2.1]ヘプタン-7-カルボニル]-1-(メトキシメチル)-7-アザビシクロ[2.2.1]ヘプタン-7-カルボニル]-1-(メトキシメチル)-7-アザビシクロ[2.2.1]ヘプタン-7-カルボニル]-1-(メトキシメチル)-7-アザビシクロ[2.2.1]ヘプタン-7-カルボキシラート
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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:
C42 H64 N4 O11
Molecular formula furigana:
C42-H64-N4-O11
Molecular weight:
800.991
InChI:
InChI=1S/C42H64N4O11/c1-38(2,3)57-37(51)46-31-11-16-42(46,24-55-7)19-27(31)35(49)44-29-9-14-40(44,22-53-5)17-25(29)33(47)43-30-10-13-39(43,21-52-4)18-26(30)34(48)45-32-12-15-41(45,23-54-6)20-28(32)36(50)56-8/h25-32H,9-24H2,1-8H3/t25-,26-,27-,28-,29-,30-,31-,32-,39+,40+,41+,42+/m1/s1
InChI key:
UVIRIKBASTWJAU-YZQYGFLTSA-N
SMILES:
COC[C@]12CC[C@H]([C@@H](C1)C(=O)N1[C@@H]3CC[C@@]1(COC)C[C@H]3C(=O)N1[C@@H]3CC[C@@]1(COC)C[C@H]3C(=O)N1[C@@H]3CC[C@@]1(COC)C[C@H]3C(=O)OC)N2C(=O)OC(C)(C)C
Systematic name (3):
(1β,4S)-4-(メトキシメチル)-7-[[(1β,4S)-4-(メトキシメチル)-7-[[(1β,4S)-4-(メトキシメチル)-7-[[(1β,4S)-4-(メトキシメチル)-7-(tert-ブチルオキシカルボニル)-7-アザビシクロ[2.2.1]ヘプタン-2α-イル]カルボニル]-7-アザビシクロ[2.2.1]ヘプタン-2α-イル]カルボニル]-7-アザビシクロ[2.2.1]ヘプタン-2α-イル]カルボニル]-7-アザビシクロ[2.2.1]ヘプタン-2α-カルボン酸メチル
tert-ブチル (1S,3R,4R)-3-[(1S,3R,4R)-3-[(1S,3R,4R)-3-[(1S,3R,4R)-3-(メトキシカルボニル)-1-(メトキシメチル)-7-アザビシクロ[2.2.1]ヘプタン-7-カルボニル]-1-(メトキシメチル)-7-アザビシクロ[2.2.1]ヘプタン-7-カルボニル]-1-(メトキシメチル)-7-アザビシクロ[2.2.1]ヘプタン-7-カルボニル]-1-(メトキシメチル)-7-アザビシクロ[2.2.1]ヘプタン-7-カルボキシラート
tert-butyl (1S,3R,4R)-3-[(1S,3R,4R)-3-[(1S,3R,4R)-3-[(1S,3R,4R)-3-(methoxycarbonyl)-1-(methoxymethyl)-7-azabicyclo[2.2.1]heptane-7-carbonyl]-1-(methoxymethyl)-7-azabicyclo[2.2.1]heptane-7-carbonyl]-1-(methoxymethyl)-7-azabicyclo[2.2.1]heptane-7-carbonyl]-1-(methoxymethyl)-7-azabicyclo[2.2.1]heptane-7-carboxylate
Other name (1):
(1β,4S)-4-(Methoxymethyl)-7-[[(1β,4S)-4-(methoxymethyl)-7-[[(1β,4S)-4-(methoxymethyl)-7-[[(1β,4S)-4-(methoxymethyl)-7-(tert-butyloxycarbonyl)-7-azabicyclo[2.2.1]heptane-2α-yl]carbonyl]-7-azabicyclo[2.2.1]heptane-2α-yl]carbonyl]-7-azabicyclo[2.2.1]heptane-2α-yl]carbonyl]-7-azabicyclo[2.2.1]heptane-2α-carboxylic acid methyl ester
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