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2H,16H-1,24-Etheno-6,10:11,15-dimethenopyrido[2',3':17,18]oxacycloei cosino[2,3,4-ij]isoquinoline, rodiasine deriv.
SpectraBase Compound ID HX2q7HPV73W
InChI InChI=1S/C36H38N2O6/c1-38-12-10-23-18-33(43-4)35(40)36-34(23)28(38)16-21-5-7-29(39)25(13-21)26-14-20(6-8-30(26)41-2)15-27-24-19-32(44-36)31(42-3)17-22(24)9-11-37-27/h5-8,13-14,17-19,27-28,37,39-40H,9-12,15-16H2,1-4H3/t27-,28+/m1/s1
InChIKey WNWKGLOUHHZEQB-IZLXSDGUSA-N
Mol Weight 594.7 g/mol
Molecular Formula C36H38N2O6
Exact Mass 594.272987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CqQA0DtCGtF
Name 2H,16H-1,24-Etheno-6,10:11,15-dimethenopyrido[2',3':17,18]oxacycloei cosino[2,3,4-ij]isoquinoline, rodiasine deriv.
CAS Registry Number 116084-92-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H38N2O6
InChI InChI=1S/C36H38N2O6/c1-38-12-10-23-18-33(43-4)35(40)36-34(23)28(38)16-21-5-7-29(39)25(13-21)26-14-20(6-8-30(26)41-2)15-27-24-19-32(44-36)31(42-3)17-22(24)9-11-37-27/h5-8,13-14,17-19,27-28,37,39-40H,9-12,15-16H2,1-4H3/t27-,28+/m1/s1
InChIKey WNWKGLOUHHZEQB-IZLXSDGUSA-N
Molecular Weight 594.708 g/mol
SMILES Oc1c(cc2CCN([C@@]3(c2c1Oc1cc2[C@@](Cc4ccc(c(-c5cc(ccc5O)C3)c4)OC)(NCCc2cc1OC)[H])[H])C)OC
SPLASH splash10-00kf-0306090000-627d4c3b61c00d0b1d68
Source of Spectrum X2-54-685-345
Synonyms Rodiasine, O7,O12,2'-tridemethyl-O12'-methyl- (+)-2'-Nortiliageine (+)-2'-Nortilliageine (+)-2,2'-Bisnorguattaguianine (1R,14S)-6,20,25-trimethoxy-15-methyl-23-oxa-15,30-diazaheptacyclo[22.6.2.1(3,7).1(8,12).1(14,18).0(22,33).0(27,31)]pentatriaconta-3(35),4,6,8(34),9,11,18(33),19,21,24,26,31-dodecaene-9,21-diol 2'-nor-tiliageine N'-demethyltiliageine
Wiley ID 1604122