CAS RN 145428-94-0
CAS RN 145428-94-0
IUPAC Namn:
(1S,11S,18S,20R,21R,22S)-4,5-dimethoxy-9-oxo-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹⁸.0²,⁷.0⁸,²².0¹¹,²¹.0¹⁵,²⁰]tetracosa-2(7),3,5,14-tetraen-17-ium
Synonymer:
(1S,11S,18S,20R,21R,22S)-4,5-dimethoxy-9-oxo-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹⁸.0²,⁷.0⁸,²².0¹¹,²¹.0¹⁵,²⁰]tetracosa-2(7),3,5,14-tetraen-17-ium
Molekylvikt (g/mol):
395.48
Molekylär sammansättning:
C23H27N2O4
InChi Key:
RRKTZKIUPZVBMF-IBTVXLQLSA-O
SMILES:
COC1=CC2=C(C=C1OC)[C@@]13CC[NH+]4CC5=CCO[C@H]6CC(=O)N2[C@H]1[C@H]6[C@H]5C[C@@H]34
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Resultat
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Brucine dihydrat, 99%, Thermo Scientific Chemicals
CAS: 145428-94-0 Molekylformel: C23H27N2O4 Molekylvikt (g/mol): 395.48 MDL-nummer: MFCD00005942 InChI-nyckel: RRKTZKIUPZVBMF-IBTVXLQLSA-O Synonym: brucine dihydrate,10,11-dimethoxystrychnine,10,11-dimethoxystrychnine dihydrate PubChem CID: 69897601 IUPAC-namn: (4aR,5aS,8aR,13aS,15aS,15bR)-10,11-dimetoxi-4a,5,5a,7,8,13a,15,15a,15b,16-dekahydro-2 H-4,6-metanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]kinolin-14-on;dihydrat LEDER: COC1=CC2=C(C=C1OC)[C@@]13CC[NH+]4CC5=CCO[C@H]6CC(=O)N2[C@H]1[C@H]6[C@H]5C[C@@H]34