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O,O-Dimethylyanangin
SpectraBase Compound ID 5i8ellEGbRO
InChI InChI=1S/C38H40N2O6/c1-39-13-11-23-19-32-33-20-25(23)28(39)17-21-7-9-30(41-3)26(15-21)27-16-22(8-10-31(27)42-4)18-29-34-24(12-14-40(29)2)35(43-5)37(44-6)38(46-32)36(34)45-33/h7-10,15-16,19-20,28-29H,11-14,17-18H2,1-6H3/t28-,29?/m0/s1
InChIKey JOTPWRMRMXPOPA-XLTVJXRZSA-N
Mol Weight 620.7 g/mol
Molecular Formula C38H40N2O6
Exact Mass 620.288637 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HspR0rVelgG
Name O,O-Dimethylyanangin
Alternate Name(s) (4(12)S)-1(6),2(6),4(5),4(6)-tetramethoxy-4(2),4(11)-dimethyl-4(1),4(2),4(3),4(4),4(9),4(10),4(11),4(12)-octahydro-4(1,12)-[1,4]dioxino[2,3-g:6,5-h']diisoquinolina-1,2(1,3)-dibenzenacyclopentaphane
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Formula C38H40N2O6
InChI InChI=1S/C38H40N2O6/c1-39-13-11-23-19-32-33-20-25(23)28(39)17-21-7-9-30(41-3)26(15-21)27-16-22(8-10-31(27)42-4)18-29-34-24(12-14-40(29)2)35(43-5)37(44-6)38(46-32)36(34)45-33/h7-10,15-16,19-20,28-29H,11-14,17-18H2,1-6H3/t28-,29?/m0/s1
InChIKey JOTPWRMRMXPOPA-XLTVJXRZSA-N
Molecular Weight 620.746 g/mol
SMILES c1(c(c2c3Oc4c(O2)cc2c(c4)[C@@](N(CC2)C)(Cc2ccc(c(-c4c(ccc(CC5c3c1CCN5C)c4)OC)c2)OC)[H])OC)OC
SPLASH splash10-00vi-0309005000-a3b37758c41747e93dfd
Source of Spectrum APC-319-848-2
Wiley ID 1788316