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(Q104955466)
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English
(3S)-5-[(1S,4aR,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Labda-8(20),14-dien-13-ol, (13R)-
1 reference
based on heuristic
inferred from SMILES
mass
290.260965708
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
manool
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3R)-5-[(1S,4aR,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3R)-5-[(1R,4aS,8aR)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(13S)-vitexifolin A
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3S)-5-[(1R,4aR,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
ent-manool
1 reference
based on heuristic
inferred from InChI
Vitexifolin A
1 reference
based on heuristic
inferred from InChI
Ent-13-epi-manool
1 reference
based on heuristic
inferred from InChI
13-epi-manool
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₄O
0 references
canonical SMILES
OC(C=C)(C)CCC1C(=C)CCC2C(C)(C)CCCC12C
0 references
isomeric SMILES
C=C[C@@](C)(O)CC[C@H]1C(=C)CC[C@@H]2C(C)(C)CCC[C@]12C
0 references
found in taxon
Picea sitchensis
1 reference
stated in
Neutral terpenes from the bark of Sitka spruce [Piceasitchensis (Bong.) Carr.]
Identifiers
InChI
InChI=1S/C20H34O/c1-7-19(5,21)14-11-16-15(2)9-10-17-18(3,4)12-8-13-20(16,17)6/h7,16-17,21H,1-2,8-14H2,3-6H3/t16-,17+,19+,20+/m0/s1
0 references
InChIKey
CECREIRZLPLYDM-ONCXSQPRSA-N
0 references
PubChem CID
12312736
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
103064473
1 reference
stated in
UniChem
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