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(Q104981929)
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English
Neohancoside D
group of stereoisomers with the chemical formula C₂₃H₃₂O₁₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
548.174120324
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₃H₃₂O₁₅
0 references
canonical SMILES
O=C(OCC1OC(OC2(OC(CO)C(O)C2O)CO)C(O)C(O)C1O)C=CC3=CC(OC)=C(O)C(OC)=C3
0 references
Identifiers
InChI
InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)27)3-4-15(26)35-8-14-17(28)19(30)20(31)22(36-14)38-23(9-25)21(32)18(29)13(7-24)37-23/h3-6,13-14,17-22,24-25,27-32H,7-9H2,1-2H3
0 references
InChIKey
DJBWDHVUJCXYBH-UHFFFAOYSA-N
0 references
PubChem CID
73157790
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DJBWDHVUJCXYBH-UHFFFAOYSA-N
ChEBI ID
181352
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)27)3-4-15(26)35-8-14-17(28)19(30)20(31)22(36-14)38-23(9-25)21(32)18(29)13(7-24)37-23/h3-6,13-14,17-22,24-25,27-32H,7-9H2,1-2H3
UniChem compound ID
70651296
1 reference
stated in
UniChem
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