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(Q105329647)
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English
(1S,2R,3S,4R)-1-hydroxy-4-[(3S)-3-hydroxy-3-methylpent-4-en-1-yl]-3,4,8,8-tetramethyl-1,2,3,5,6,7-hexahydronaphthalen-2-yl acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
[1-Hydroxy-4-(3-hydroxy-3-methylpent-4-enyl)-3,4,8,8-tetramethyl-1,2,3,5,6,7-hexahydronaphthalen-2-yl] acetate
1 reference
based on heuristic
inferred from SMILES
Vitetrifolin F
1 reference
based on heuristic
inferred from SMILES
mass
364.261359632
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
[(1S,2R,3S,4R)-1-hydroxy-4-[(3R)-3-hydroxy-3-methylpent-4-enyl]-3,4,8,8-tetramethyl-1,2,3,5,6,7-hexahydronaphthalen-2-yl] acetate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₃₆O₄
0 references
canonical SMILES
O=C(OC1C(O)C2=C(CCCC2(C)C)C(C)(CCC(O)(C=C)C)C1C)C
0 references
isomeric SMILES
C=C[C@@](C)(O)CC[C@@]1(C)C2=C([C@H](O)[C@H](OC(C)=O)[C@H]1C)C(C)(C)CCC2
0 references
found in taxon
Vitex trifolia
2 references
stated in
New norditerpenoids with trypanocidal activity from Vitex trifolia.
stated in
Four new halimane-type diterpenes, vitetrifolins D-G, from the fruit of Vitex trifolia
Identifiers
InChI
InChI=1S/C22H36O4/c1-8-21(6,25)12-13-22(7)14(2)19(26-15(3)23)18(24)17-16(22)10-9-11-20(17,4)5/h8,14,18-19,24-25H,1,9-13H2,2-7H3/t14-,18+,19-,21-,22-/m1/s1
0 references
InChIKey
XKQBKQUOQCQQBX-LEWHPQSYSA-N
0 references
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