Structure

Sophoramine

CAS
6882-66-2
Catalog Number
ACM6882662
Category
Other Products
Molecular Weight
244.33
Molecular Formula
C15H20N2O

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Specification

Synonyms
11,12,13,14-Tetradehydromatridin-15-one
InChI
InChI=1S/C15H20N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h1,6-7,11-12,15H,2-5,8-10H2/t11-,12+,15-/m0/s1
InChI Key
MMCQRJPAMIHLQX-ZOWXZIJZSA-N
Melting Point
164-165 °C
Complexity
440
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
3
Exact Mass
244.157563266
Heavy Atom Count
18
Hydrogen Bond Acceptor Count
2
Hydrogen Bond Donor Count
0
Isomeric SMILES
C1C[C@H]2CN3C(=O)C=CC=C3[C@@H]4[C@H]2N(C1)CCC4
Monoisotopic Mass
244.157563266
Physical State
Powder
Rotatable Bond Count
0
Topological Polar Surface Area
23.6 Ų
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