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(+)-SEMPERVIRAMINOL;(20S)-2-ALPHA-HYDROXY-6-ALPHA-ACETOXY-3-BETA-BENZOYLAMINO-20-DIMETHYLAMINO-9,10-SECO-BUXA-1(10)-ENE
SpectraBase Compound ID GQihTArdg0L
InChI InChI=1S/C35H52N2O4/c1-21(37(7)8)26-15-17-35(6)27-20-29(41-22(2)38)30-25(18-24(27)14-16-34(26,35)5)19-28(39)31(33(30,3)4)36-32(40)23-12-10-9-11-13-23/h9-13,19,21,24,26-31,39H,14-18,20H2,1-8H3,(H,36,40)/t21-,24+,26+,27+,28+,29-,30-,31-,34+,35-/m0/s1
InChIKey DMWFVSJPHMUFEL-NYTMBKBPSA-N
Mol Weight 564.8 g/mol
Molecular Formula C35H52N2O4
Exact Mass 564.392708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ArMDTpLo7r
Name Semperviraminol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H52N2O4
InChI InChI=1S/C35H52N2O4/c1-21(37(7)8)26-15-17-35(6)27-20-29(41-22(2)38)30-25(18-24(27)14-16-34(26,35)5)19-28(39)31(33(30,3)4)36-32(40)23-12-10-9-11-13-23/h9-13,19,21,24,26-31,39H,14-18,20H2,1-8H3,(H,36,40)/t21-,24+,26+,27+,28+,29-,30-,31-,34+,35-/m0/s1
InChIKey DMWFVSJPHMUFEL-NYTMBKBPSA-N
Molecular Weight 564.811 g/mol
SMILES N([C@@]1(C([C@@]2([C@](C[C@@]3([C@@](CC2=C[C@]1(O)[H])(CC[C@]1([C@]3(CC[C@@]1([C@@](N(C)C)(C)[H])[H])C)C)[H])[H])(OC(=O)C)[H])[H])(C)C)[H])C(=O)c1ccccc1
SPLASH splash10-00di-9400010000-9a19874205d14d5d85db
Source of Spectrum G4-61-669-1
Wiley ID 1607809