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(Q105366393)
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English
(2R)-2-[(4bS,8aS,10R)-10-(acetyloxy)-3-hydroxy-4b,8,8-trimethyl-1,4-dioxo-5,6,7,8a,9,10-hexahydrophenanthren-2-yl]propyl acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-[10-(acetyloxy)-3-hydroxy-4b,8,8-trimethyl-1,4-dioxo-5,6,7,8a,9,10-hexahydrophenanthren-2-yl]propyl acetate
1 reference
based on heuristic
inferred from SMILES
mass
432.214803364
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₄H₃₂O₇
0 references
canonical SMILES
O=C1C(=C(O)C(=O)C2=C1C(OC(=O)C)CC3C2(C)CCCC3(C)C)C(C)COC(=O)C
0 references
isomeric SMILES
CC(=O)OC[C@H](C)C1=C(O)C(=O)C2=C(C1=O)[C@H](OC(C)=O)C[C@H]1C(C)(C)CCC[C@]21C
0 references
found in taxon
Isodon lophanthoides
2 references
stated in
Abietane quinones from Rabdosia lophanthoides
stated in
Flavonoids from Isodon oresbius
Identifiers
InChI
InChI=1S/C24H32O7/c1-12(11-30-13(2)25)17-20(27)18-15(31-14(3)26)10-16-23(4,5)8-7-9-24(16,6)19(18)22(29)21(17)28/h12,15-16,28H,7-11H2,1-6H3/t12-,15+,16-,24-/m0/s1
0 references
InChIKey
YWASIXNBVRBKEG-MUNUTPGCSA-N
0 references
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