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Solanidine [80-78-4]

 
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Identification
Copyright
CAS # 80-78-4, Solanidine
Name
Solanidine
Synonyms
Chebi:28374; Solanid-5-En-3Beta-Ol; Ccris 6508
Molecular Formula
C27H43NO
Molecular Weight 397.64
CAS Registry Number
80-78-4
EINECS 201-309-5
SMILES
[C@@]12(C)[C@@H]5[C@H](C[C@H]1[C@H]3[C@H](CC2)[C@]4(C)C(=CC3)C[C@H](CC4)O)N6[C@@H]([C@H]5C)CC[C@@H](C6)C
InChI
1S/C27H43NO/c1-16-5-8-23-17(2)25-24(28(23)15-16)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16-17,19-25,29H,5,7-15H2,1-4H3/t16-,17+,19-,20+,21-,22-,23+,24-,25-,26-,27-/m0/s1
InChIKey JVKYZPBMZPJNAJ-OQFNDJACSA-N
down Properties
Desity 1.1g/cm3 (Cal.)  ref.
Boiling point 503.132°C at 760 mmHg (Cal.)  ref.
Flash point 223.467°C (Cal.)  ref.
down References
(1) Jacob Pollier, Tessa Moses and Alain Goossens. Combinatorial biosynthesis in plants: A (p)review on its potential and future exploitation, Nat. Prod. Rep., 2011, 28, 1897.
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