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(Q74417432)
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English
(12E)-labda-8(17),12,14-triene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
diterpene
0 references
4,4,8a-trimethyl-7-methylidene-8-(3-methylpenta-2,4-dienyl)-2,3,4a,5,6,8-hexahydro-1H-naphthalene
1 reference
based on heuristic
inferred from SMILES
mass
272.250401024
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
glaucane
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(12Z)-Labda-8(20),12,14-triene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(Z)-biformene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
syn-labda-8(17),12E,14-triene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(4aR,8S,8aS)-4,4,8a-trimethyl-7-methylidene-8-[(2E)-3-methylpenta-2,4-dienyl]-2,3,4a,5,6,8-hexahydro-1H-naphthalene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(4aS,8R,8aR)-4,4,8a-trimethyl-7-methylidene-8-[(2Z)-3-methylpenta-2,4-dienyl]-2,3,4a,5,6,8-hexahydro-1H-naphthalene
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₂
0 references
canonical SMILES
C=CC(=CCC1C(=C)CCC2C(C)(C)CCCC12C)C
0 references
isomeric SMILES
C/C(=C\C[C@H]1C(=C)CC[C@@H]2[C@@]1(CCCC2(C)C)C)/C=C
0 references
found in taxon
Juniperus sabina
1 reference
stated in
Terpenoids from Juniperus sabina
Palafoxia rosea
1 reference
stated in
Neue labdan- und pimaren-derivate aus Palafoxia rosea
Identifiers
InChI
InChI=1S/C20H32/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h7,9,17-18H,1,3,8,10-14H2,2,4-6H3/b15-9+/t17-,18-,20+/m0/s1
0 references
InChIKey
VJVMMXUPZGOBSN-DIUMXTPXSA-N
2 references
stated in
ChEBI release 2019-11-01
stated in
ChEBI release 2020-09-01
PubChem CID
23252995
1 reference
matched by identifier from
InChIKey
InChIKey
VJVMMXUPZGOBSN-DIUMXTPXSA-N
Reaxys registry number
2557623
1 reference
stated in
ChEBI release 2019-11-01
ChEBI ID
138302
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H32/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h7,9,17-18H,1,3,8,10-14H2,2,4-6H3/b15-9+/t17-,18-,20+/m0/s1
UniChem compound ID
58422162
1 reference
stated in
UniChem
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