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(Q105142581)
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English
Paeoniflorin, galloyl-
group of stereoisomers with the chemical formula C₃₀H₃₂O₁₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
pinane monoterpenoid
1 reference
inferred from
pinane monoterpenoid
mass
632.174120324
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₃₂O₁₅
0 references
canonical SMILES
O=C(OCC1OC(OC23CC4C5(O)OC(OC2(C)C5)C43COC(=O)C=6C=CC=CC6)C(O)C(O)C1O)C7=CC(O)=C(O)C(O)=C7
0 references
found in taxon
Chinese peony
1 reference
stated in
Androgen modulators from the roots of Paeonia lactiflora (paeoniae radix) grown and processed in nara prefecture, Japan
Paeonia veitchii
1 reference
stated in
Monoterpene glycosides from Paeonia hybrida
Paeonia × suffruticosa
1 reference
stated in
Monoterpene glycosides from Paeonia hybrida
Identifiers
InChI
InChI=1S/C30H32O15/c1-27-11-29(39)18-9-30(27,28(18,26(44-27)45-29)12-41-23(37)13-5-3-2-4-6-13)43-25-22(36)21(35)20(34)17(42-25)10-40-24(38)14-7-15(31)19(33)16(32)8-14/h2-8,17-18,20-22,25-26,31-36,39H,9-12H2,1H3
0 references
InChIKey
KLFIUQCKSSAFFU-UHFFFAOYSA-N
0 references
PubChem CID
494717
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
KLFIUQCKSSAFFU-UHFFFAOYSA-N
UniChem compound ID
64339578
1 reference
stated in
UniChem
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