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(Q81984851)
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English
Bulnesol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
guaiane sesquiterpenoid
0 references
mass
222.198365452
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₆O
0 references
canonical SMILES
OC(C)(C)C1CCC(=C2CCC(C)C2C1)C
0 references
isomeric SMILES
CC1=C2CC[C@H](C)[C@@H]2C[C@H](C(C)(C)O)CC1
0 references
found in taxon
Callitris columellaris
1 reference
stated in
(−)-Eudesma-1,4(15),11-triene from the essential oil of Callitris intratropica
Callitris intratropica
1 reference
stated in
(−)-Eudesma-1,4(15),11-triene from the essential oil of Callitris intratropica
Artemisia annua
1 reference
stated in
Chemical composition and antioxidant and antimicrobial activity of essential oil of Artemisia annua L. from Bosnia
Identifiers
InChI
InChI=1S/C15H26O/c1-10-5-7-12(15(3,4)16)9-14-11(2)6-8-13(10)14/h11-12,14,16H,5-9H2,1-4H3/t11-,12+,14-/m0/s1
0 references
InChIKey
LGOFSGDSFQNIAT-SCRDCRAPSA-N
0 references
CAS Registry Number
22451-73-6
1 reference
InChIKey
LGOFSGDSFQNIAT-SCRDCRAPSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=22451-73-6
PubChem CID
12302134
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
LGOFSGDSFQNIAT-SCRDCRAPSA-N
ChEBI ID
167421
mapping relation type
exact match
2 references
stated in
ChEBI release 2021-03-01
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H26O/c1-10-5-7-12(15(3,4)16)9-14-11(2)6-8-13(10)14/h11-12,14,16H,5-9H2,1-4H3/t11-,12+,14-/m0/s1
SureChEMBL ID
SCHEMBL2696394
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LGOFSGDSFQNIAT-SCRDCRAPSA-N
UniChem compound ID
50819371
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID4051873
1 reference
matched by identifier from
InChIKey
InChIKey
LGOFSGDSFQNIAT-SCRDCRAPSA-N
DSSTOX compound identifier
DTXCID7030432
0 references
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