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(Q105368922)
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Chlorantene B
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
5-hydroxy-3,5,8a-trimethyl-8-nitro-6,7,8,9-tetrahydro-4aH-benzo[f][1]benzofuran-4-one
1 reference
based on heuristic
inferred from SMILES
mass
293.126322708
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₉NO₅
0 references
canonical SMILES
O=C1C2=C(OC=C2C)CC3(C)C1C(O)(C)CCC3[N+](=O)[O-]
0 references
isomeric SMILES
Cc1coc2c1C(=O)[C@H]1[C@](C)(O)CC[C@@H]([N+](=O)[O-])[C@]1(C)C2
0 references
found in taxon
Chloranthus serratus
2 references
stated in
Sesquiterpenoids and phenylpropanoids from Chloranthus serratus
stated in
Sesquiterpenoids and phenylpropanoids from Chloranthus serratus
Identifiers
InChI
InChI=1S/C15H19NO5/c1-8-7-21-9-6-14(2)10(16(19)20)4-5-15(3,18)13(14)12(17)11(8)9/h7,10,13,18H,4-6H2,1-3H3/t10-,13-,14+,15-/m1/s1
0 references
InChIKey
YYUKCGXOQJSCQD-QPKOPYBWSA-N
0 references
PubChem CID
25180316
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YYUKCGXOQJSCQD-QPKOPYBWSA-N
UniChem compound ID
32161124
1 reference
stated in
UniChem
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