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Catalog Number | ACM5545891 |
CAS Number | 5545-89-1 |
Synonyms | 1-Demethylcalycanthidine |
Molecular Weight | 346.5 |
InChI | InChI=1S/C22H26N4/c1-25-13-11-21(15-7-3-5-9-17(15)23-19(21)25)22-12-14-26(2)20(22)24-18-10-6-4-8-16(18)22/h3-10,19-20,23-24H,11-14H2,1-2H3/t19-,20-,21+,22+/m0/s1 |
InChI Key | HOYXPMHLHJOGHD-FNAHDJPLSA-N |
Melting Point | 188-189 °C |
Purity | 90%+ |
Complexity | 531 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 4 |
Exact Mass | 346.21574685 |
Heavy Atom Count | 26 |
Hydrogen Bond Acceptor Count | 4 |
Hydrogen Bond Donor Count | 2 |
Isomeric SMILES | CN1CC[C@@]2([C@H]1NC3=CC=CC=C32)[C@@]45CCN([C@@H]4NC6=CC=CC=C56)C |
Monoisotopic Mass | 346.21574685 |
PhysicalState | Powder |
Rotatable Bond Count | 1 |
Topological Polar Surface Area | 30.5 Ų |
What is the chemical formula for chimonanthine?
The chemical formula for chimonanthine is C22H26N4.
What is the molecular weight of chimonanthine?
The molecular weight of chimonanthine is 346.47.
What is the synonym for chimonanthine that refers to its (3aS,3a'S,8aS,8a'S)-stereoisomer?
The synonym for chimonanthine that refers to its (3aS,3a'S,8aS,8a'S)-stereoisomer is l-Chimonanthine.
What is the melting point of chimonanthine?
The melting point of chimonanthine is 188-189°C.
In what form should chimonanthine be stored?
Chimonanthine should be stored at -20°C.
Is chimonanthine soluble in DMSO?
Yes, chimonanthine is soluble in DMSO.
What is the ChEBI definition of chimonanthine?
The ChEBI definition of chimonanthine refers to the (3aS,3a'S,8aS,8a'S)-stereoisomer of chimonanthine.
What is the CAS number for chimonanthine?
The CAS number for chimonanthine is 5545-89-1.
What are some other synonyms for chimonanthine?
Some other synonyms for chimonanthine include chimonanthin, 1-Demethylcalycanthidine, and 3a,3'a(1H,1'H)-Bipyrrolo[2,3-b]indole.
How is chimonanthine chemically classified?
Chimonanthine is chemically classified as a hexahydropyrrolo[2,3-b]indole compound.
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