Chem
J-GLOBAL ID:200907081439196220
Nikkaji number:J2.685.898D
Boc-O-(1-O,6-O-Dibenzoyl-3-O,4-O-isopropylidene-β-D-psicofuranosyl)-L-Ser-OMe
Boc-O-(1-O,6-O-ジベンゾイル-3-O,4-O-イソプロピリデン-β-D-プシコフラノシル)-L-Ser-OMe
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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:
C32 H39 NO12
Molecular formula furigana:
C32-H39-N-O12
Molecular weight:
629.659
InChI:
InChI=1S/C32H39NO12/c1-30(2,3)45-29(37)33-22(28(36)38-6)17-41-32(19-40-27(35)21-15-11-8-12-16-21)25-24(43-31(4,5)44-25)23(42-32)18-39-26(34)20-13-9-7-10-14-20/h7-16,22-25H,17-19H2,1-6H3,(H,33,37)/t22-,23+,24+,25+,32+/m0/s1
InChI key:
SWBOUWHEFRPSAQ-AZZFZRESSA-N
SMILES:
COC(=O)[C@H](CO[C@]1(COC(=O)c2ccccc2)O[C@H](COC(=O)c2ccccc2)[C@H]2OC(C)(C)O[C@@H]12)NC(=O)OC(C)(C)C
Systematic name (3):
Boc-O-(1-O,6-O-ジベンゾイル-3-O,4-O-イソプロピリデン-β-D-プシコフラノシル)-L-Ser-OMe
[(3aR,4R,6R,6aR)-6-[(ベンゾイルオキシ)メチル]-4-[(2S)-2-{[(tert-ブトキシ)カルボニル]アミノ}-3-メトキシ-3-オキソプロポキシ]-2,2-ジメチル-テトラヒドロ-2H-フロ[3,4-d][1,3]ジオキソール-4-イル]メチル ベンゾアート
[(3aR,4R,6R,6aR)-6-[(benzoyloxy)methyl]-4-[(2S)-2-{[(tert-butoxy)carbonyl]amino}-3-methoxy-3-oxopropoxy]-2,2-dimethyl-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]methyl benzoate
Other name (1):
Boc-O-(1-O,6-O-Dibenzoyl-3-O,4-O-isopropylidene-β-D-psicofuranosyl)-L-Ser-OMe
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