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(Q105134752)
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English
1,1,4a,7,7',8a-hexamethylspiro[2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-8,2'-3H-1-benzofuran]-2,5'-diol
group of stereoisomers with the chemical formula C₂₇H₄₀O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
isocopalane diterpenoid
1 reference
inferred from
isocopalane diterpenoid
grisan-type benzofuranoid
1 reference
inferred from
grisan-type benzofuranoid
mass
412.2977451399999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₇H₄₀O₃
0 references
canonical SMILES
OC=1C=C(C=2OC3(CC2C1)C(C)CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C
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Identifiers
InChI
InChI=1S/C27H40O3/c1-16-13-19(28)14-18-15-27(30-23(16)18)17(2)7-8-21-25(5)11-10-22(29)24(3,4)20(25)9-12-26(21,27)6/h13-14,17,20-22,28-29H,7-12,15H2,1-6H3
0 references
InChIKey
JTFQPSRKDMDRKT-UHFFFAOYSA-N
0 references
PubChem CID
72742987
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JTFQPSRKDMDRKT-UHFFFAOYSA-N
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