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(Q105182561)
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English
(1S,3S,4S,4aR,8aR)-3,4a,8,8-tetramethyl-4-(3-methylidenepent-4-enyl)-2,4,5,6,7,8a-hexahydro-1H-naphthalene-1,3-diol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3,4a,8,8-tetramethyl-4-(3-methylidenepent-4-enyl)-2,4,5,6,7,8a-hexahydro-1H-naphthalene-1,3-diol
1 reference
based on heuristic
inferred from SMILES
mass
306.255880328
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1R,3S,4S,4aR,8aR)-3,4a,8,8-tetramethyl-4-(3-methylidenepent-4-enyl)-2,4,5,6,7,8a-hexahydro-1H-naphthalene-1,3-diol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1R,3S,4S,4aR,8aS)-3,4a,8,8-tetramethyl-4-(3-methylidenepent-4-enyl)-2,4,5,6,7,8a-hexahydro-1H-naphthalene-1,3-diol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₄O₂
0 references
canonical SMILES
OC1CC(O)(C)C(CCC(=C)C=C)C2(C)CCCC(C)(C)C12
0 references
isomeric SMILES
C=CC(=C)CC[C@@H]1[C@@](C)(O)C[C@H](O)[C@@H]2C(C)(C)CCC[C@@]12C
0 references
found in taxon
Sideritis argyrea
2 references
stated in
Phytochemical Analysis of Some Sideritis Species of Turkey
stated in
Diterpenes from Sideritis argyrea
Identifiers
InChI
InChI=1S/C20H34O2/c1-7-14(2)9-10-16-19(5)12-8-11-18(3,4)17(19)15(21)13-20(16,6)22/h7,15-17,21-22H,1-2,8-13H2,3-6H3/t15-,16-,17+,19-,20-/m0/s1
0 references
InChIKey
NOFWEQLJCJWTBS-GCLMUHHRSA-N
0 references
PubChem CID
163069698
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NOFWEQLJCJWTBS-GCLMUHHRSA-N
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