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(Q105218522)
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English
(1R,2R,4aS,7S,8aS)-2-(2-hydroxypropan-2-yl)-4a-methyl-8-methylidene-2,3,4,5,6,7-hexahydro-1H-naphthalene-1,7,8a-triol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-(2-hydroxypropan-2-yl)-4a-methyl-8-methylidene-2,3,4,5,6,7-hexahydro-1H-naphthalene-1,7,8a-triol
1 reference
based on heuristic
inferred from SMILES
mass
270.183109312
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₆O₄
0 references
canonical SMILES
OC1C(=C)C2(O)C(O)C(CCC2(C)CC1)C(O)(C)C
0 references
isomeric SMILES
C=C1[C@@H](O)CC[C@]2(C)CC[C@@H](C(C)(C)O)[C@@H](O)[C@@]12O
0 references
found in taxon
Chrysanthemum indicum
1 reference
stated in
New Sesquiterpenes from the Flowers of Chrysanthemum indicum L.
Dendranthema indicum
1 reference
stated in
New Sesquiterpenes from the Flowers of Chrysanthemum indicum L.
Identifiers
InChI
InChI=1S/C15H26O4/c1-9-11(16)6-8-14(4)7-5-10(13(2,3)18)12(17)15(9,14)19/h10-12,16-19H,1,5-8H2,2-4H3/t10-,11+,12-,14+,15+/m1/s1
0 references
InChIKey
QCSGSHSFCRXBSQ-MIBAYGRRSA-N
0 references
PubChem CID
139070030
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QCSGSHSFCRXBSQ-MIBAYGRRSA-N
UniChem compound ID
154060890
1 reference
stated in
UniChem
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