Napelline

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Catalog Number
ACM5008526
Product Name
Napelline
Structure
Structure
CAS
5008-52-6
Category
Heterocyclic Organic Compound
Molecular Weight
359.5
Molecular Formula
C22H33NO3
InChI
InChI=1S/C22H33NO3/c1-4-23-10-20(3)6-5-17(25)22-15(20)7-13(18(22)23)21-9-12(11(2)19(21)26)14(24)8-16(21)22/h12-19,24-26H,2,4-10H2,1,3H3/t12,13,14-,15,16,17-,18+,19+,20-,21-,22/m0/s1
InChI Key
AZAZKLKDEOMJBJ-KSCSQDNTSA-N
Melting Point
149 °C
Complexity
695
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
6
Exact Mass
359.24604391
Heavy Atom Count
26
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
3
Isomeric SMILES
CCN1C[C@@]2(CC[C@@H](C34[C@H]1C(CC23)[C@]56C4C[C@@H](C(C5)C(=C)[C@H]6O)O)O)C
Monoisotopic Mass
359.24604391
Physical State
Powder
Rotatable Bond Count
1
Topological Polar Surface Area
63.9 Ų
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