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D-xylo-Octa-5,7-dienitol, 1-azido-1,5,7,8-tetradeoxy-6-S-phenyl-2,3,4-tris-O-(phenylmethyl)-6-thio-, (5E)-
SpectraBase Compound ID EaOMs3IXt7y
InChI InChI=1S/C35H35N3O3S/c1-2-31(42-32-21-13-6-14-22-32)23-33(39-25-28-15-7-3-8-16-28)35(41-27-30-19-11-5-12-20-30)34(24-37-38-36)40-26-29-17-9-4-10-18-29/h2-23,33-35H,1,24-27H2/b31-23+/t33-,34+,35+/m1/s1
InChIKey VEZJLQMCFCSFIH-IPTISQRWSA-N
Mol Weight 577.7 g/mol
Molecular Formula C35H35N3O3S
Exact Mass 577.239913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3BFaLAULejp
Name D-xylo-Octa-5,7-dienitol, 1-azido-1,5,7,8-tetradeoxy-6-S-phenyl-2,3,4-tris-O-(phenylmethyl)-6-thio-, (5E)-
CAS Registry Number 128845-40-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H35N3O3S
InChI InChI=1S/C35H35N3O3S/c1-2-31(42-32-21-13-6-14-22-32)23-33(39-25-28-15-7-3-8-16-28)35(41-27-30-19-11-5-12-20-30)34(24-37-38-36)40-26-29-17-9-4-10-18-29/h2-23,33-35H,1,24-27H2/b31-23+/t33-,34+,35+/m1/s1
InChIKey VEZJLQMCFCSFIH-IPTISQRWSA-N
Molecular Weight 577.743 g/mol
SMILES C(N=[N+]=[N-])[C@@]([C@]([C@@](\C=C/(Sc1ccccc1)C=C)(OCc1ccccc1)[H])(OCc1ccccc1)[H])(OCc1ccccc1)[H]
SPLASH splash10-0006-9100000000-b8c66e0d847ba505cb3c
Source of Spectrum J-55-5731-57
Synonyms (-)-(E)-(5R,6S,7S)-8-Azido-3-(phenylthio)-5,6,7-tris(benzyloxy)-1,3-octadiene (5E)-1-azido-2,3,4-tri-O-benzyl-1,5,7,8-tetradeoxy-6-S-phenyl-6-thio-D-xylo-octa-5,7-dienitol
Wiley ID 1408303