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(Q104375958)
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Isocurcumenol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-Methyl-6-methylidene-9-(propan-2-ylidene)-11-oxatricyclo[6.2.1.0^{1,5}]undecan-8-ol
1 reference
based on heuristic
inferred from SMILES
mass
234.161979944
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1S,2S,5S,8S)-2-methyl-6-methylidene-9-propan-2-ylidene-11-oxatricyclo[6.2.1.01,5]undecan-8-ol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₂O₂
0 references
canonical SMILES
OC12OC3(CC1=C(C)C)C(C(=C)C2)CCC3C
0 references
isomeric SMILES
C=C1C[C@@]2(O)O[C@@]3(CC2=C(C)C)[C@@H](C)CC[C@@H]13
0 references
found in taxon
Curcuma harmandii
1 reference
stated in
Volatile Constituents of the Leaf, Stem, Rhizome, Roof and Flower Oils ofCurcuma harmandiiGagnep. from Vietnam
Curcuma zedoaria
3 references
stated in
Curcumenone, curcumanolide A and curcumanolide B, three sesquiterpenoids from curcuma zedoaria
stated in
Hepatoprotective constituents from zedoariae rhizoma: absolute stereostructures of three new carabrane-type sesquiterpenes, curcumenolactones A, B, and C.
stated in
Medicinal foodstuffs. XXVIII. Inhibitors of nitric oxide production and new sesquiterpenes, zedoarofuran, 4-epicurcumenol, neocurcumenol, gajutsulactones A and B, and zedoarolides A and B, from Zedoariae Rhizoma
Curcuma heyneana
2 references
stated in
Terpenoids from Curcuma heyneana
stated in
Bioactive sesquiterpenes from Curcuma ochrorhiza and Curcuma heyneana
Cyperus rotundus
1 reference
stated in
Modulation of radioligand binding to the GABA(A)-benzodiazepine receptor complex by a new component from Cyperus rotundus
Identifiers
InChI
InChI=1S/C15H22O2/c1-9(2)13-8-14-11(4)5-6-12(14)10(3)7-15(13,16)17-14/h11-12,16H,3,5-8H2,1-2,4H3/t11-,12-,14-,15+/m0/s1
0 references
InChIKey
DEBDFZGNZTYPMF-NZBPQXDJSA-N
0 references
CAS Registry Number
24063-71-6
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
10399139
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DEBDFZGNZTYPMF-NZBPQXDJSA-N
ChEBI ID
196142
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H22O2/c1-9(2)13-8-14-11(4)5-6-12(14)10(3)7-15(13,16)17-14/h11-12,16H,3,5-8H2,1-2,4H3/t11-,12-,14-,15+/m0/s1
UniChem compound ID
351093
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID701020836
1 reference
matched by identifier from
InChIKey
InChIKey
DEBDFZGNZTYPMF-NZBPQXDJSA-N
UNII
UE4RKR80F1
1 reference
matched by identifier from
InChIKey
InChIKey
DEBDFZGNZTYPMF-NZBPQXDJSA-N
Probes And Drugs ID
PD127189
0 references
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