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(Q82919067)
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English
Phyllanthine
group of stereoisomers with the chemical formula C₁₄H₁₇NO₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
(8S)-4-methoxy-14-oxa-7-azatetracyclo[6.6.1.01,11.02,7]pentadeca-9,11-dien-13-one
1 reference
based on heuristic
inferred from SMILES
mass
247.120843404
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₁₇NO₃
0 references
canonical SMILES
O=C1OC23C(C=CC(N4CCC(OC)CC42)C3)=C1
0 references
isomeric SMILES
CO[C@@H]1CCN2[C@@H]3C=CC4=CC(=O)OC4(C3)[C@H]2C1
0 references
found in taxon
Phyfnnvik eyyfn
1 reference
stated in
4-Methoxy-nor-Securinine, a New Alkaloid from Phyllanthus niruri
Phyllanthus virgatus
1 reference
stated in
Simplexine (14-hydroxy-4-methoxy-13,14-dihydronorsecurinine): An alkaloid from Phyllanthus simplex
Identifiers
InChI
InChI=1S/C14H17NO3/c1-17-11-4-5-15-10-3-2-9-6-13(16)18-14(9,8-10)12(15)7-11/h2-3,6,10-12H,4-5,7-8H2,1H3/t10-,11-,12-,14?/m1/s1
0 references
InChIKey
YKLWRYOORWTCQQ-ZXRVKKJVSA-N
0 references
CAS Registry Number
20072-02-0
0 references
PubChem CID
193552
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
68690152
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40942096
0 references
DSSTOX compound identifier
DTXCID301370512
0 references
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