Chem
J-GLOBAL ID:200907066303850059
Nikkaji number:J690.468H
Mannopine
マンノピン
Download MOL file
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:
C11 H22 N2 O8
Molecular formula furigana:
C11-H22-N2-O8
Molecular weight:
310.303
InChI:
InChI=1S/C11H22N2O8/c12-8(17)2-1-5(11(20)21)13-3-6(15)9(18)10(19)7(16)4-14/h5-7,9-10,13-16,18-19H,1-4H2,(H2,12,17)(H,20,21)/t5-,6+,7+,9+,10+/m0/s1
InChI key:
VPRLICVDSGMIKO-SZWOQXJISA-N
SMILES:
NC(=O)CC[C@H](NC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(=O)O
Systematic name (3):
N2 -[(2R,3R,4R,5R)-2,3,4,5,6-ペンタヒドロキシヘキシル]-L-グルタミン
(2S)-4-カルバモイル-2-{[(2R,3R,4R,5R)-2,3,4,5,6-ペンタヒドロキシヘキシル]アミノ}ブタン酸
(2S)-4-carbamoyl-2-{[(2R,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino}butanoic acid
Other name (3):
マンノピン
Mannopine
N2 -[(2R,3R,4R,5R)-2,3,4,5,6-Pentahydroxyhexyl]-L-glutamine
CAS registry number:
87084-52-4
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