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(Q105171527)
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English
[3-acetyloxy-2-[5-(5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentoxy]-5-hydroxy-6-methyloxan-4-yl] acetate
group of stereoisomers with the chemical formula C₃₀H₅₀O₇
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Statements
instance of
group of stereoisomers
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subclass of
labdanes
1 reference
inferred from
labdanes
mass
522.3556539399998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₀H₅₀O₇
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canonical SMILES
O=C(OC1C(OCCC(C)CCC2C(=C)CCC3C(C)(C)CCCC23C)OC(C)C(O)C1OC(=O)C)C
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Identifiers
InChI
InChI=1S/C30H50O7/c1-18(10-12-23-19(2)11-13-24-29(6,7)15-9-16-30(23,24)8)14-17-34-28-27(37-22(5)32)26(36-21(4)31)25(33)20(3)35-28/h18,20,23-28,33H,2,9-17H2,1,3-8H3
0 references
InChIKey
MSXXXXFUZQUDIO-UHFFFAOYSA-N
0 references
PubChem CID
162924911
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MSXXXXFUZQUDIO-UHFFFAOYSA-N
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