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Home> Encyclopedia > Hot Product Listed 2   > 20H-6,20-Methano-11,15-metheno-1H,8H-benzo[g]pyrido[2,1-d][1,5]oxaazacyclohexadecin-8-one,2,3,4,4a,5...
345954-49-6 structure

20H-6,20-Methano-11,15-metheno-1H,8H-benzo[g]pyrido[2,1-d][1,5]oxaazacyclohexadecin-8-one,2,3,4,4a,5,6-hexahydro-14-hydroxy-17,18-dimethoxy-, (4aR,6S,9Z,20S)-

Iupac Name:ethyl 1-(2-aminoacetyl)piperidine-4-carboxylate;hydrochloride
CAS No.:345954-49-6
EINECS(EC#): 227-602-8
Molecular Weight:250.723
Molecular Formula:C6H12 (isomer)
Names and Identifiers
Synonyms

(10-alpha)-4'',5''-dimethoxy-2'-hydroxylythran-12-one 20H-6,20-Methano-11,15-metheno-1H,8H-benzo[g]pyrido[2,1-d][1,5]oxaazacyclohexadecin-8-one,2,3,4,4a,5,6-hexahydro-14-hydroxy-17,18-dimethoxy-, [4aR-(4aR*,6S*,9Z,20S*)]- CHEMBL1173218 Cryogenine cryogenine (alkaloid) LS-88513 lythran-12-one, 2'-hydroxy-4'',5''-dimethoxy-, (10.alpha.)- lythran-12-one, 2'-hydroxy-4'',5''-dimethoxy-, (10alpha)- lythran-12-one, 4'',5''-dimethoxy-2'-hydroxy-, (10-alpha)- Lythran-12-one,2'-hydroxy-4'',5''-dimethoxy-, (10a)- nsc 272693 SCHEMBL1119034 vertine vertine (7ci,8ci)

Inchi
InChI=1S/C10H18N2O3.ClH/c1-2-15-10(14)8-3-5-12(6-4-8)9(13)7-11;/h8H,2-7,11H2,1H3;1H
InChkey
JEXYZSDMNGNVKU-UHFFFAOYSA-N
Canonical Smiles
CCOC(=O)C1CCN(CC1)C(=O)CN.Cl
Properties
Boiling Point
°Cat760mmHg
Flash Point
253.7°C
HS Code
2933399090
Computational chemical data
  • Molecular Weight:250.723g/mol
  • Molecular Formula:C6H12
  • Compound Is Canonicalized:True
  • Exact Mass:250.108
  • Monoisotopic Mass:250.108
  • Complexity:235
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:72.6A^2
  • Heavy Atom Count:16
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:2
  • CACTVS Substructure Key Fingerprint: AAADceBzMAAEAAAAAAAAAAAAAAAAAAAAAAAsAAAAAAAAAAAAAAAAHgAQAAAADQDhgAYCCANABAAI AAGQGAAAAAAAAAAAAIGIAAAAQBIAgAAWAAAEBgCAAAA0AAAKAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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