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(Q105325447)
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English
20-Deoxocarnosol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(-)-20-Deoxocarnosol
1 reference
based on heuristic
inferred from SMILES
(1R,8S)-11,11-dimethyl-5-propan-2-yl-16-oxatetracyclo[6.6.2.01,10.02,7]hexadeca-2,4,6-triene-3,4-diol
1 reference
based on heuristic
inferred from SMILES
mass
316.203844756
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1R,8R,10R)-11,11-dimethyl-5-propan-2-yl-16-oxatetracyclo[6.6.2.01,10.02,7]hexadeca-2,4,6-triene-3,4-diol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₈O₃
0 references
canonical SMILES
OC=1C(O)=C2C(=CC1C(C)C)C3OCC24CCCC(C)(C)C4C3
0 references
isomeric SMILES
CC(C)c1cc2c(c(O)c1O)[C@@]13CCCC(C)(C)[C@@H]1C[C@@H]2OC3
0 references
found in taxon
Salvia pachyphylla
1 reference
stated in
Abietane diterpenoids from Salvia pachyphylla and S. clevelandii with cytotoxic activity against human cancer cell lines.
Plectranthus barbatus
1 reference
stated in
An abietane diterpene from the labiate Coleus barbatus
Salvia columbariae
1 reference
stated in
Columbaridione, a diterpenequinone from Salvia columbariae
Coleus barbatus
1 reference
stated in
An abietane diterpene from the labiate Coleus barbatus
Identifiers
InChI
InChI=1S/C20H28O3/c1-11(2)12-8-13-14-9-15-19(3,4)6-5-7-20(15,10-23-14)16(13)18(22)17(12)21/h8,11,14-15,21-22H,5-7,9-10H2,1-4H3/t14-,15-,20+/m0/s1
0 references
InChIKey
XCVWKCGUFCXDHN-AUSJPIAWSA-N
0 references
PubChem CID
13855851
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XCVWKCGUFCXDHN-AUSJPIAWSA-N
UniChem compound ID
603100
1 reference
stated in
UniChem
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