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(Q105347890)
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English
Notoginsenoside J
group of stereoisomers with the chemical formula C₄₂H₇₄O₁₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
protostane/dammarane triterpenoid
1 reference
inferred from
protostane/dammarane triterpenoid
mass
834.497686288
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₄₂H₇₄O₁₆
0 references
canonical SMILES
OCC1OC(OC2CC3(C)C(CC(O)C4C(CCC43C)C(OC5OC(CO)C(O)C(O)C5O)(C)CCC(O)C(O)(C)C)C6(C)CCC(O)C(C)(C)C26)C(O)C(O)C1O
0 references
found in taxon
Panax
1 reference
stated in
Phytochemical and analytical studies of Panax notoginseng (Burk.) F.H. Chen
Panax notoginseng
1 reference
stated in
Q110077290
Identifiers
InChI
InChI=1S/C42H74O16/c1-37(2)25(46)10-12-39(5)24-15-20(45)27-19(42(8,14-11-26(47)38(3,4)54)58-36-33(53)31(51)29(49)23(18-44)57-36)9-13-40(27,6)41(24,7)16-21(34(37)39)55-35-32(52)30(50)28(48)22(17-43)56-35/h19-36,43-54H,9-18H2,1-8H3
0 references
InChIKey
YFXPRCDUBFSHJY-UHFFFAOYSA-N
0 references
PubChem CID
85212136
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
32014903
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0031757
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YFXPRCDUBFSHJY-UHFFFAOYSA-N
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