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English
grayanotoxin III
group of stereoisomers with the chemical formula C₂₀H₃₄O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
grayanotoxane diterpenoid
1 reference
inferred from
grayanotoxane diterpenoid
mass
370.235538808
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₃₄O₆
0 references
canonical SMILES
OC1CC2C(O)(C)C3CCC4C(O)C3(CC(O)C2(O)C1(C)C)CC4(O)C
0 references
found in taxon
Rhododendron metternichii
1 reference
stated in
[Studies on the constituents of Rhododendron metternichii Sieb. et Zucc. var. hondoense Nakai (author's transl)]
Identifiers
InChI
InChI=1S/C20H34O6/c1-16(2)13(21)7-12-18(4,25)11-6-5-10-15(23)19(11,9-17(10,3)24)8-14(22)20(12,16)26/h10-15,21-26H,5-9H2,1-4H3
0 references
InChIKey
BWMFRQKICHXLSH-UHFFFAOYSA-N
0 references
PubChem CID
3511
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
BWMFRQKICHXLSH-UHFFFAOYSA-N
UniChem compound ID
27258992
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0248396
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BWMFRQKICHXLSH-UHFFFAOYSA-N
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