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(Q110202654)
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English
4-({5-[(3,4-dihydroxy-6-methyl-5-{[4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}oxan-2-yl)oxy]-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl}oxy)-2,3,5,6-tetrahydroxyhexanal
group of stereoisomers with the chemical formula C₂₅H₄₃NO₁₈
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
645.2480135359998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₅H₄₃NO₁₈
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canonical SMILES
O=CC(O)C(O)C(OC1OC(CO)C(OC2OC(C)C(NC3C=C(CO)C(O)C(O)C3O)C(O)C2O)C(O)C1O)C(O)CO
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Identifiers
InChI
InChI=1S/C25H43NO18/c1-7-13(26-9-2-8(3-27)14(33)18(37)15(9)34)17(36)20(39)24(41-7)44-23-12(6-30)42-25(21(40)19(23)38)43-22(11(32)5-29)16(35)10(31)4-28/h2,4,7,9-27,29-40H,3,5-6H2,1H3
0 references
InChIKey
CEMXHAPUFJOOSV-UHFFFAOYSA-N
0 references
PubChem CID
21021667
1 reference
based on heuristic
inferred from InChIKey
UniChem compound ID
23257737
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0247887
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CEMXHAPUFJOOSV-UHFFFAOYSA-N
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