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(Q82916339)
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English
3,4a,7,7,10a-Pentamethyl-3-(oxiran-2-yl)dodecahydro-1H-naphtho[2,1-b]pyran-8-ol
chemical compound
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
322.25079494799996
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₀H₃₄O₃
0 references
canonical SMILES
OC1CCC2(C)C3CCC(OC3(C)CCC2C1(C)C)(C)C4OC4
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isomeric SMILES
CC1(C)C(O)CC[C@]2(C)[C@@H]1CC[C@]1(C)O[C@@](C)([C@@H]3CO3)CC[C@H]12
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Identifiers
InChI
InChI=1S/C20H34O3/c1-17(2)13-6-10-19(4)14(18(13,3)9-8-15(17)21)7-11-20(5,23-19)16-12-22-16/h13-16,21H,6-12H2,1-5H3/t13-,14+,15?,16+,18-,19+,20-/m1/s1
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InChIKey
PTHZRTUJGFIYPR-URUVSLSHSA-N
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CAS Registry Number
183957-04-2
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PubChem CID
177380
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
64693379
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70939777
0 references
DSSTOX compound identifier
DTXCID501368266
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