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(Q104972493)
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English
(7abeta)-1beta-[2-Methoxy-2-methylpropyl]-3aalpha-methyl-7-methylenehydrindane-4alpha-ol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
1-(2-methoxy-2-methylpropyl)-3a-methyl-7-methylidene-2,3,4,5,6,7a-hexahydro-1H-inden-4-ol
1 reference
based on heuristic
inferred from SMILES
mass
252.208930136
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₂₈O₂
0 references
canonical SMILES
OC1CCC(=C)C2C(CCC12C)CC(OC)(C)C
0 references
isomeric SMILES
C=C1CC[C@@H](O)[C@]2(C)CC[C@H](CC(C)(C)OC)[C@@H]12
0 references
found in taxon
Erigeron annuus
1 reference
stated in
Five New Sesquiterpenoids and a New Diterpenoid from Erigeron annuus (L.) PERS., Erigeron philadelphicus L. and Erigeron sumatrensis RETZ
Identifiers
InChI
InChI=1S/C16H28O2/c1-11-6-7-13(17)16(4)9-8-12(14(11)16)10-15(2,3)18-5/h12-14,17H,1,6-10H2,2-5H3/t12-,13-,14-,16+/m1/s1
0 references
InChIKey
CYQGXILAKXOOOO-KQTLUZQSSA-N
0 references
PubChem CID
10923031
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CYQGXILAKXOOOO-KQTLUZQSSA-N
UniChem compound ID
32465425
1 reference
stated in
UniChem
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