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11-Hydroxy-12-(hydroxymethyl)-2,3-dimethoxy-5,8,8a,9,10,11,12,12a,13,13a-decahydro-6H-isoquino[3,2-a]isoquinolin-10-yl 3,4,5-trimethoxybenzoate

View entire compound with spectra: 1 MS (GC)

11-Hydroxy-12-(hydroxymethyl)-2,3-dimethoxy-5,8,8a,9,10,11,12,12a,13,13a-decahydro-6H-isoquino[3,2-a]isoquinolin-10-yl 3,4,5-trimethoxybenzoate
SpectraBase Compound ID 89rYfU6f5GP
InChI InChI=1S/C30H39NO9/c1-35-23-8-16-6-7-31-14-18-11-25(40-30(34)17-9-26(37-3)29(39-5)27(10-17)38-4)28(33)21(15-32)19(18)12-22(31)20(16)13-24(23)36-2/h8-10,13,18-19,21-22,25,28,32-33H,6-7,11-12,14-15H2,1-5H3
InChIKey GNROLPZPIZRXQM-UHFFFAOYSA-N
Mol Weight 557.6 g/mol
Molecular Formula C30H39NO9
Exact Mass 557.262482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EACblN92pDC
Name 11-Hydroxy-12-(hydroxymethyl)-2,3-dimethoxy-5,8,8a,9,10,11,12,12a,13,13a-decahydro-6H-isoquino[3,2-a]isoquinolin-10-yl 3,4,5-trimethoxybenzoate
Alternate Name(s) 14.beta.-Hydroxy-13.alpha.hydroxymethyl-7,8-dimethoxy-15.beta.(3,4,5-trimethoxybenzoyloxy)alloberban 3,4,5-trimethoxybenzoic acid (11-hydroxy-2,3-dimethoxy-12-methylol-6,8,8a,9,10,11,12,12a,13,13a-decahydro-5H-isoquinolin[2,1-b]isoquinolin-10-yl) ester 3,4,5-trimethoxybenzoic acid [11-hydroxy-12-(hydroxymethyl)-2,3-dimethoxy-6,8,8a,9,10,11,12,12a,13,13a-decahydro-5H-isoquinolino[2,1-b]isoquinolin-10-yl] ester [11-hydroxy-12-(hydroxymethyl)-2,3-dimethoxy-6,8,8a,9,10,11,12,12a,13,13a-decahydro-5H-isoquinolino[2,1-b]isoquinolin-10-yl] 3,4,5-trimethoxybenzoate
CAS Registry Number 63911-57-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H39NO9
InChI InChI=1S/C30H39NO9/c1-35-23-8-16-6-7-31-14-18-11-25(40-30(34)17-9-26(37-3)29(39-5)27(10-17)38-4)28(33)21(15-32)19(18)12-22(31)20(16)13-24(23)36-2/h8-10,13,18-19,21-22,25,28,32-33H,6-7,11-12,14-15H2,1-5H3
InChIKey GNROLPZPIZRXQM-UHFFFAOYSA-N
Molecular Weight 557.640 g/mol
SMILES OCC1C2CC3c4cc(c(cc4CCN3CC2CC(C1O)OC(c1cc(c(c(c1)OC)OC)OC)=O)OC)OC
SPLASH splash10-0btd-0449030000-07aec424b52a86ff5785
Source of Spectrum W5-1989-8905-1
Wiley ID 1406492