CHEBI:93509 - (8aR,12aS,13aS)-12-ethylsulfonyl-3-methoxy-5,6,8,8a,9,10,11,12a,13,13a-decahydroisoquinolino[2,1-g][1,6]naphthyridine

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ChEBI Name (8aR,12aS,13aS)-12-ethylsulfonyl-3-methoxy-5,6,8,8a,9,10,11,12a,13,13a-decahydroisoquinolino[2,1-g][1,6]naphthyridine
ChEBI ID CHEBI:93509
Stars This entity has been manually annotated by a third party.
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Formula C19H28N2O3S
Net Charge 0
Average Mass 364.504
Monoisotopic Mass 364.18206
InChI InChI=1S/C19H28N2O3S/c1-3-25(22,23)21-9-4-5-15-13-20-10-8-14-11-16(24-2)6-7-17(14)19(20)12-18(15)21/h6-7,11,15,18-19H,3-5,8-10,12-13H2,1-2H3/t15-,18+,19+/m1/s1
InChIKey UMGBFFAJXFXOIL-MNEFBYGVSA-N
SMILES CCS(=O)(=O)N1CCC[C@H]2[C@@H]1C[C@H]3C4=C(CCN3C2)C=C(C=C4)OC
ChEBI Ontology
Outgoing (8aR,12aS,13aS)-12-ethylsulfonyl-3-methoxy-5,6,8,8a,9,10,11,12a,13,13a-decahydroisoquinolino[2,1-g][1,6]naphthyridine (CHEBI:93509) is a naphthyridine derivative (CHEBI:73539)
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