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(Q105146010)
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English
(1S,3E,5S,9S,12E)-3,12-dimethyl-8-methylidene-6,18-dioxatricyclo[14.2.1.05,9]nonadeca-3,12,16(19)-triene-7,17-dione
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3,12-Dimethyl-8-methylidene-6,18-dioxatricyclo[14.2.1.05,9]nonadeca-3,12,16(19)-triene-7,17-dione
1 reference
based on heuristic
inferred from SMILES
mass
328.167459248
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3aS,6E,13S,15E,16aR)-3a,4,5,8,9,13,14,16a-Octahydro-6,15-dimethyl-3-methylene-11H-13,10-methenofuro[2,3-f]oxacyclopentadecin-2,11(3H)-dione
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
3,7,11,15(17)-Cembratetraene-16,2:19,6-diolide
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₄O₄
0 references
canonical SMILES
O=C1OC2C=C1CCC=C(C)CCC3C(=C)C(=O)OC3C=C(C)C2
0 references
isomeric SMILES
C=C1C(=O)O[C@H]2/C=C(\C)C[C@H]3C=C(CC/C=C(\C)CC[C@@H]12)C(=O)O3
0 references
found in taxon
Anisomeles indica
2 references
stated in
Bioactive cembrane diterpenoids of Anisomeles indica
stated in
5,6-Dimethoxy-7,3′,4′-trihydroxyflavone from Anisomeles ovata
Isodon sculponeatus
1 reference
stated in
ent-Kaurane and cembrane diterpenoids from Isodon sculponeatus and their cytotoxicity
Identifiers
InChI
InChI=1S/C20H24O4/c1-12-5-4-6-15-11-16(23-20(15)22)9-13(2)10-18-17(8-7-12)14(3)19(21)24-18/h5,10-11,16-18H,3-4,6-9H2,1-2H3/b12-5+,13-10+/t16-,17-,18-/m0/s1
0 references
InChIKey
KTYZKXFERQUCPX-KJBZNBRFSA-N
0 references
PubChem CID
38347018
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
6024089
1 reference
stated in
UniChem
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