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(Q76010232)
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Ngaione
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
farnesane sesquiterpenoid
0 references
mass
250.156894564
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Ipomoeamarone
1 reference
based on heuristic
inferred from InChI
1-[(2S,5S)-5-(furan-3-yl)-2-methyloxolan-2-yl]-4-methylpentan-2-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₂O₃
0 references
canonical SMILES
O=C(CC(C)C)CC1(OC(C2=COC=C2)CC1)C
0 references
isomeric SMILES
CC(C)CC(=O)C[C@]1(CC[C@H](O1)C2=COC=C2)C
0 references
found in taxon
Eremophila deserti
1 reference
stated in
Terpenoid chemistry. XXIV. (1R)-1-Methoxymyodesert-3-ene, an Iridoid Constitutent of Myoporum deserti (Myoporaceae)
Myoporum laetum
2 references
stated in
CCXCVIII.—Constituents of Myoporum laetum, forst (the “ngaio”). Part I
stated in
Natural derivatives of furan. I. Ngaione
Myoporum acuminatum
1 reference
stated in
Natural derivatives of furan. I. Ngaione
Myoporum tenuifolium
1 reference
stated in
Natural derivatives of furan. I. Ngaione
Identifiers
InChI
InChI=1S/C15H22O3/c1-11(2)8-13(16)9-15(3)6-4-14(18-15)12-5-7-17-10-12/h5,7,10-11,14H,4,6,8-9H2,1-3H3/t14-,15+/m0/s1
0 references
InChIKey
WOFDWNOSFDVCDF-LSDHHAIUSA-N
0 references
CAS Registry Number
581-12-4
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
120744
1 reference
matched by identifier from
InChIKey
InChIKey
WOFDWNOSFDVCDF-LSDHHAIUSA-N
ChEBI ID
137722
mapping relation type
exact match
2 references
stated in
ChEBI release 2021-03-01
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H22O3/c1-11(2)8-13(16)9-15(3)6-4-14(18-15)12-5-7-17-10-12/h5,7,10-11,14H,4,6,8-9H2,1-3H3/t14-,15+/m0/s1
UniChem compound ID
32644565
1 reference
stated in
UniChem
LIPID MAPS ID
LMPR0103020001
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
30 June 2018
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