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Voafoline, 2'-hydroxy-
SpectraBase Compound ID LGDTqs0Yefr
InChI InChI=1S/C42H48N4O5/c1-3-38-19-24-18-37(23-46-29-11-7-5-9-27(29)41(42(24,46)48)13-16-44(35(38)41)21-30-32(38)51-30)22-45-15-12-40-26-8-4-6-10-28(26)43-31(40)25(33(47)49-2)20-39(34(40)45)14-17-50-36(37)39/h4-11,24,30,32,34-36,43,48H,3,12-23H2,1-2H3/t24-,30-,32-,34+,35+,36+,37+,38-,39+,40+,41-,42-/m1/s1
InChIKey ZNXICWHZBIHQPC-LKYSXCTRSA-N
Mol Weight 688.9 g/mol
Molecular Formula C42H48N4O5
Exact Mass 688.362471 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KKYPEvjLTfD
Name Voafoline, 2'-hydroxy-
CAS Registry Number 32063-91-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H48N4O5
InChI InChI=1S/C42H48N4O5/c1-3-38-19-24-18-37(23-46-29-11-7-5-9-27(29)41(42(24,46)48)13-16-44(35(38)41)21-30-32(38)51-30)22-45-15-12-40-26-8-4-6-10-28(26)43-31(40)25(33(47)49-2)20-39(34(40)45)14-17-50-36(37)39/h4-11,24,30,32,34-36,43,48H,3,12-23H2,1-2H3/t24-,30-,32-,34+,35+,36+,37+,38-,39+,40+,41-,42-/m1/s1
InChIKey ZNXICWHZBIHQPC-LKYSXCTRSA-N
Molecular Weight 688.869 g/mol
SMILES N1c2c([C@]34C1=C(C[C@]15[C@]([C@@]6(C[C@@]7(C[C@]8([C@]9([C@@]%10([C@]7(N(C6)c6c%10cccc6)O)CCN9C[C@@]6([C@]8(O6)[H])[H])[H])CC)[H])CN([C@]41[H])CC3)(OCC5)[H])C(=O)OC)cccc2
SPLASH splash10-0079-0000609000-72e9762d826af40e89ca
Source of Spectrum H-60-2855-1
Synonyms 2'-Hydroxyvoafoline Methyl 14-ethyl-12-hydroxy-15',16-dioxa-8,8',19,19'-tetraazaspiro[heptacyclo[10.9.1.1(1,14).0(2,7).0(8,22).0(15,17).0(19,23)]tricosane-10,17'-hexacyclo[10.9.1.0(1,9).0(2,7).0(12,16).0(19,22)]docosane]-2,2',4,4',6,6',9'-heptaene-10'-carboxylate Spiro[1H,15ah-furo[2',3':7,8]indolizino[8,1-cd]carbazole-2(2aH),2'(3' h)-[1H,12H,14H]oxireno[6,7]indolizino[8,1-cd]pyrido[1,2,3-lm]carbazole], voafoline deriv. Voafolidine
Wiley ID 1414621