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(Q105369819)
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Nanolobatin B
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
1-(4,12-Dimethyl-9-methylidene-5-oxatricyclo[8.2.0.04,6]dodecan-12-yl)-4-hydroxy-4-methylpent-2-en-1-one
1 reference
based on heuristic
inferred from SMILES
mass
318.21949482
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₃₀O₃
0 references
canonical SMILES
O=C(C=CC(O)(C)C)C1(C)CC2C(=C)CCC3OC3(C)CCC21
0 references
isomeric SMILES
C=C1CC[C@@H]2O[C@@]2(C)CC[C@H]2[C@H]1C[C@]2(C)C(=O)/C=C/C(C)(C)O
0 references
found in taxon
Sinularia nanolobata
2 references
stated in
New beta-caryophyllene-derived terpenoids from the soft coral Sinularia nanolobata
stated in
New beta-caryophyllene-derived terpenoids from the soft coral Sinularia nanolobata
Identifiers
InChI
InChI=1S/C20H30O3/c1-13-6-7-17-20(5,23-17)11-8-15-14(13)12-19(15,4)16(21)9-10-18(2,3)22/h9-10,14-15,17,22H,1,6-8,11-12H2,2-5H3/b10-9+/t14-,15-,17-,19-,20-/m0/s1
0 references
InChIKey
ZADUJBOYWSBTGW-JQVHTRMZSA-N
0 references
PubChem CID
10064493
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
ZADUJBOYWSBTGW-JQVHTRMZSA-N
UniChem compound ID
65288
1 reference
stated in
UniChem
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