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(Q105151966)
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English
Physacoztomatin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
5-(2,5,5,8a-Tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)-3-methylpent-2-ene-1,4-diol
1 reference
based on heuristic
inferred from SMILES
mass
306.255880328
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(E,4R)-5-[(1S,4aS,8aR)-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]-3-methylpent-2-ene-1,4-diol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₄O₂
0 references
canonical SMILES
OCC=C(C)C(O)CC1C(=CCC2C(C)(C)CCCC12C)C
0 references
isomeric SMILES
CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1C[C@@H](O)/C(C)=C/CO
0 references
found in taxon
Physalis coztomatl
3 references
stated in
Labdanes and withanolides from Physalis coztomatl
stated in
Sucrose esters from the fruits of Physalis nicandroides var. attenuata
stated in
Labdanes and Withanolides from Physalis coztomatl
Physalis sordida
1 reference
stated in
Labdanes and sucrose esters from Physalis sordida
Identifiers
InChI
InChI=1S/C20H34O2/c1-14-7-8-18-19(3,4)10-6-11-20(18,5)16(14)13-17(22)15(2)9-12-21/h7,9,16-18,21-22H,6,8,10-13H2,1-5H3/b15-9+/t16-,17+,18-,20+/m0/s1
0 references
InChIKey
LHUGFIFIFQNHDA-BVTYEUJZSA-N
0 references
PubChem CID
49799161
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LHUGFIFIFQNHDA-BVTYEUJZSA-N
UniChem compound ID
252976
1 reference
stated in
UniChem
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