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(Q74417338)
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8-geranylumbelliferone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2,6-dimethyloctane monoterpenoid
0 references
biogenic coumarin
0 references
monoterpenoid
0 references
mass
298.156894564
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₂O₃
0 references
canonical SMILES
O=C1OC2=C(C=C1)C=CC(O)=C2CC=C(C)CCC=C(C)C
0 references
isomeric SMILES
CC(C)=CCC/C(C)=C/Cc1c(O)ccc2ccc(=O)oc12
1 reference
based on heuristic
inferred from InChI
found in taxon
Philotheca tomentella
2 references
stated in
Novel C-Geranyl 7-Hydroxycoumarins from the Aerial Parts of Eriostemon tomentellus
stated in
Novel C-Geranyl 7-Hydroxycoumarins from the Aerial Parts of Eriostemon tomentellus
Boronia lanceolata
2 references
stated in
Novel angular pyranocoumarins from Boronia lanceolata
stated in
Novel angular pyranocoumarins from Boronia lanceolata
Luvunga sarmentosa
2 references
stated in
Apotirucallane triterpenoids from Luvunga sarmentosa (Rutaceae).
stated in
Apotirucallane triterpenoids from Luvunga sarmentosa (Rutaceae).
Boronia inornata
1 reference
stated in
Terpenoids, alkaloids and coumarins from Boronia inornata and Boronia gracilipes
Pamburus missionis
1 reference
stated in
Coumarins and an indole alkaloid from Pamburus missionis
Atalantia buxifolia
2 references
stated in
Constituents of the root bark of Severinia buxifolia collected in Hainan
stated in
A New Sesquiterpene, α-Santalane-11,12,13-Triol from the Root Bark ofSeverinia Buxifoliain Hainan
Identifiers
InChI
InChI=1S/C19H22O3/c1-13(2)5-4-6-14(3)7-10-16-17(20)11-8-15-9-12-18(21)22-19(15)16/h5,7-9,11-12,20H,4,6,10H2,1-3H3/b14-7+
0 references
InChIKey
QPMKRRUDQIKGNH-VGOFMYFVSA-N
2 references
stated in
ChEBI release 2019-11-01
stated in
ChEBI release 2020-09-01
CAS Registry Number
23660-05-1
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
71694409
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
QPMKRRUDQIKGNH-VGOFMYFVSA-N
Reaxys registry number
6959110
1 reference
stated in
ChEBI release 2019-11-01
ChEBI ID
134358
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C19H22O3/c1-13(2)5-4-6-14(3)7-10-16-17(20)11-8-15-9-12-18(21)22-19(15)16/h5,7-9,11-12,20H,4,6,10H2,1-3H3/b14-7+
SureChEMBL ID
SCHEMBL24075636
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QPMKRRUDQIKGNH-VGOFMYFVSA-N
UniChem compound ID
51088197
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID201151248
1 reference
matched by identifier from
InChIKey
InChIKey
QPMKRRUDQIKGNH-VGOFMYFVSA-N
KNApSAcK ID
C00019878
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QPMKRRUDQIKGNH-VGOFMYFVSA-N
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