(-)-Senecionine
CAS Registry Number®
130-01-8
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CAS Name
(-)-SenecionineMolecular Formula
C18H25NO5Molecular Mass
335.39Cite this Page
(-)-Senecionine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=130-01-8 (retrieved ) (CAS RN: 130-01-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
236 °CDensity (2)
1.266 g/cm³
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
- (2) Mackay, M. F.; Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry, (1982), B38(10), 2754-8, CAplus
Other Names and Identifiers
InChI
InChI=1S/C18H25NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,11,14-15,22H,6-10H2,1-3H3/b12-4-/t11-,14-,15-,18-/m1/s1
InChIKey
InChIKey=HKODIGSRFALUTA-JTLQZVBZSA-N
SMILES
O=C/1O[C@]2([C@@]3(N(CC2)CC=C3COC(=O)[C@](C)(O)[C@H](C)C\C1=C\C)[H])[H]
Canonical SMILES
O=C1OC2CCN3CC=C(COC(=O)C(O)(C)C(C)CC1=CC)C32
Other Names for this Substance
- [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-, (3Z,5R,6R,14aR,14bR)-
- Senecionine
- Senecionan-11,16-dione, 12-hydroxy-
- (3Z,5R,6R,14aR,14bR)-3-Ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-5,6-dimethyl[1,6]dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione
- Aureine
Deleted or Replaced CAS Registry Numbers
11002-70-3, 11024-76-3
