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(Q104922396)
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Daphniyunnine D
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
16-Hydroxy-2,6-dimethyl-8-azahexacyclo[11.5.1.11,5.02,10.03,8.016,19]icos-13(19)-ene-14,20-dione
1 reference
based on heuristic
inferred from SMILES
mass
341.199093724
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Daphniyunnine E
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₇NO₃
0 references
canonical SMILES
O=C1C2=C3C(O)(C1)CCC43C(=O)C5CC6N(CC5C)CC(CC2)C64C
0 references
isomeric SMILES
C[C@@H]1CN2C[C@H]3CCC4=C5[C@@]6(CC[C@@]5(O)CC4=O)C(=O)[C@@H]1C[C@@H]2[C@@]36C
0 references
found in taxon
Daphniphyllum paxianum
1 reference
stated in
Daphnipaxianines A-D, alkaloids from Daphniphyllum paxianum
Daphniphyllum yunnanense
1 reference
stated in
Daphniyunnines A-E, alkaloids from Daphniphyllum yunnanense.
Daphniphyllum majus
1 reference
stated in
Daphniyunnines A-E, alkaloids from Daphniphyllum yunnanense.
Identifiers
InChI
InChI=1S/C21H27NO3/c1-11-9-22-10-12-3-4-13-15(23)8-20(25)5-6-21(17(13)20)18(24)14(11)7-16(22)19(12,21)2/h11-12,14,16,25H,3-10H2,1-2H3/t11-,12-,14-,16-,19-,20-,21+/m1/s1
0 references
InChIKey
BASSTWHCAWRGHM-QXLLIFFRSA-N
0 references
PubChem CID
11709882
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BASSTWHCAWRGHM-QXLLIFFRSA-N
UniChem compound ID
38076
1 reference
stated in
UniChem
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