| Identification | Back Directory | [Name]
senecionine N-oxide | [CAS]
13268-67-2 | [Synonyms]
Senecionine oxide
Senecionin-N-oxid
senecionine N-oxide
12-Hydroxysenecionan-11,16-dione 4-oxide
[1,6]Dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-5,6-dimethyl-, 12-oxide, (3Z,5R,6R,14aR,14bR)- | [Molecular Formula]
C18H25NO6 | [MDL Number]
MFCD01750097 | [MOL File]
13268-67-2.mol | [Molecular Weight]
351.39 |
| Chemical Properties | Back Directory | [form ]
Solid | [pka]
12.77±0.40(Predicted) | [color ]
White to off-white | [InChI]
InChI=1S/C18H25NO6/c1-4-12-9-11(2)18(3,22)17(21)24-10-13-5-7-19(23)8-6-14(15(13)19)25-16(12)20/h4-5,11,14-15,22H,6-10H2,1-3H3/b12-4-/t11-,14-,15-,18-,19?/m1/s1 | [InChIKey]
PLGBHVNNYDZWGZ-GPUZEBNTSA-N | [SMILES]
[N+]12([O-])CC=C3COC(=O)[C@@](O)(C)[C@H](C)C/C(=C/C)/C(=O)O[C@@]([H])([C@]13[H])CC2 |
| Hazard Information | Back Directory | [Uses]
Senecionine N-oxide is the major pyrrolizidine alkaloid in Senecio vulgaris, a native herb of the British Isles. Senecionine N-oxide is hepatotoxic, and is suspected to be an antifertility agent in rats. Despite its toxicity, it is also being regarded as an antiproliferative agent for tumour growth. | [Definition]
ChEBI: Senecionine N-oxide is a tertiary amine oxide. It is functionally related to a senecionine. |
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