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EPHEDRADINE-A-TRIACETATE
SpectraBase Compound ID DJTFCnYs1dS
InChI InChI=1S/C34H42N4O7/c1-22(39)36-15-4-5-16-37-17-6-14-35-31(42)21-29(38(23(2)40)19-7-18-36)26-10-13-30-28(20-26)32(34(37)43)33(45-30)25-8-11-27(12-9-25)44-24(3)41/h8-13,20,29,32-33H,4-7,14-19,21H2,1-3H3,(H,35,42)
InChIKey HGLIEVSRYHDKHE-UHFFFAOYSA-N
Mol Weight 618.7 g/mol
Molecular Formula C34H42N4O7
Exact Mass 618.30535 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AoDVSN7fjXm
Name 4H-1,16-Etheno-5,15-(propaniminoethano)furo[3,4-l][1,5,10]triazacyclohexadecine-4,21-dione, 10,14-diacetyl-3-[4-(acetyloxy)phenyl]-3,3a,6,7,8,9,10,11,12,13,14,15-dodecahydro-
Alternate Name(s) N(6),N(10),O(34)-Triacetyl-aphelandrine N,N,O-Triacetylaphelandrine N6,N10,O-Triacetylaphelandrine
CAS Registry Number 69755-30-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H42N4O7
InChI InChI=1S/C34H42N4O7/c1-22(39)36-15-4-5-16-37-17-6-14-35-31(42)21-29(38(23(2)40)19-7-18-36)26-10-13-30-28(20-26)32(34(37)43)33(45-30)25-8-11-27(12-9-25)44-24(3)41/h8-13,20,29,32-33H,4-7,14-19,21H2,1-3H3,(H,35,42)
InChIKey HGLIEVSRYHDKHE-UHFFFAOYSA-N
Molecular Weight 618.731 g/mol
SMILES N1C(CC2N(CCCN(CCCCN(CCC1)C(C1c3c(ccc2c3)OC1c1ccc(cc1)OC(C)=O)=O)C(C)=O)C(C)=O)=O
SPLASH splash10-02vi-0292023000-7892a7df6f65e742402b
Source of Spectrum H-61-2660-0
Wiley ID 1411408