Isoline (alkaloid)
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Isoline (alkaloid)
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CAS No:
30000-36-3
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Formula:
C20H29NO7
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Chemical Name:
Isoline (alkaloid)
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Synonyms:
[1,6]Dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione,6-(acetyloxy)-3-ethyl-3,4,5,6,9,11,13,14,14a,14b-decahydro-3-hydroxy-5,6-dimethyl-,(3R,5R,6S,14aR,14bR)-;Isoline;(3R,5R,6S,14aR,14bR)-6-(Acetyloxy)-3-ethyl-3,4,5,6,9,11,13,14,14a,14b-decahydro-3-hydroxy-5,6-dimethyl[1,6]dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione;Isoline (alkaloid);Ruwenine
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CAS No:
Computed Properties
Molecular Weight:395.4
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:395.19440226
Monoisotopic Mass:395.19440226
Topological Polar Surface Area:102
Heavy Atom Count:28
Complexity:705
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes