For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(-)-ANTIOQUINE
SpectraBase Compound ID 3MpqQbgWN9p
InChI InChI=1S/C37H40N2O6/c1-38-12-10-23-18-32(43-4)33-20-25(23)28(38)16-21-6-8-30(40)26(14-21)27-15-22(7-9-31(27)42-3)17-29-35-24(11-13-39(29)2)19-34(44-5)36(41)37(35)45-33/h6-9,14-15,18-20,28-29,40-41H,10-13,16-17H2,1-5H3/t28-,29+/m0/s1
InChIKey MNNXIEANPHEHSB-URLMMPGGSA-N
Mol Weight 608.7 g/mol
Molecular Formula C37H40N2O6
Exact Mass 608.288637 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID B1cwooiU6CZ
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 121960-20-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H40N2O6
InChI InChI=1S/C37H40N2O6/c1-38-12-10-23-18-32(43-4)33-20-25(23)28(38)16-21-6-8-30(40)26(14-21)27-15-22(7-9-31(27)42-3)17-29-35-24(11-13-39(29)2)19-34(44-5)36(41)37(35)45-33/h6-9,14-15,18-20,28-29,40-41H,10-13,16-17H2,1-5H3/t28-,29+/m0/s1
InChIKey MNNXIEANPHEHSB-URLMMPGGSA-N
Molecular Weight 608.735 g/mol
SMILES Oc1c2c3[C@@](Cc4cc(-c5c(ccc(C[C@]6(c7cc(O2)c(cc7CCN6C)OC)[H])c5)O)c(cc4)OC)(N(CCc3cc1OC)C)[H]
SPLASH splash10-000x-0906002000-49f80a231040c4ddef4e
Source of Spectrum I-67-277-1
Synonyms Rodiasine, O7-demethyl-, (1.alpha.,1'.alpha.)- Cordobine
Wiley ID 1410779