Strychochrysine structure

Strychochrysine

(1R,11S,12R,13R,14E,19S,21S)-10-(3-ethyl-7,12-dihydro-6H-indolo[2,3-a]quinolizin-5-ium-2-yl)-14-(2-hydroxyethylidene)-8,16-diazahexacyclo[11.5.2.11,8.02,7.016,19.012,21]henicosa-2,4,6,9-tetraen-11-ol

Also Known As: Strychochrysine|12H-Indolo[2, 2-[2,3,11a,11b,13,13a-hex ahydro-11-hydroxy-14-(2-hydroxyethylidene)-12H-1,12-ethano- 11H-pyrido[1,2,3-lm]pyrrolo[2,3-d]carbazol-10-yl]-3-ethyl-, [1S-(1.alpha.,3aS*,11.beta.,11a.beta.,11b.alpha.,12.alpha.,13a.beta.,14E)]-|3-Ethyl-2-[(3aR,11S,11aR,11bS,12R,13aS,14E)-11-hydroxy-14-(2-hydroxyethylidene)-2,3,11a,12,13,13a-hexahydro-11H,11bH-1,12-ethanopyrido[1,2,3-lm]pyrrolo[2,3-d]carbazol-10-yl]-7,12-dihydro-6H-indolo[2,3-a]quinolizin-5-ium

CAS: 201009-99-6
Molecular Formula C38H39N4O2+
Molecular Weight 583.3073 g/mol
LogP 4.7256
Topological Polar Surface Area 66.61 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
Rotatable Bonds 3
Exact Mass 583.3073
Monoisotopic Mass 583.3073
Heavy Atoms 44
Complexity 1938.2502

Chemical Identifiers

CAS Number 201009-99-6
SMILES CCC1=C[N+]2=C(C=C1C3=CN4[C@H]5[C@H]([C@@H]3O)[C@H]\6C[C@H]7[C@@]5(CCN7C/C6=C/CO)C8=CC=CC=C84)C9=C(CC2)C1=CC=CC=C1N9

Product Overview

Strychochrysine (CAS 201009-99-6), with molecular formula C38H39N4O2+ and molecular weight 583.3073 g/mol. IUPAC: (1R,11S,12R,13R,14E,19S,21S)-10-(3-ethyl-7,12-dihydro-6H-indolo[2,3-a]quinolizin-5-ium-2-yl)-14-(2-hydroxyethylidene)-8,16-diazahexacyclo[11.5.2.11,8.02,7.016,19.012,21]henicosa-2,4,6,9-tetraen-11-ol.

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