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3-O-Benzyl-2-t-butyloxycarbonylamino-2-deoxy-5,6-O-isopropylidene-1-O-triphenylmethyl-D-glalacitol
SpectraBase Compound ID J1Zo9B2VdMY
InChI InChI=1S/C40H47NO7/c1-38(2,3)48-37(43)41-33(36(44-26-29-18-10-6-11-19-29)35(42)34-28-45-39(4,5)47-34)27-46-40(30-20-12-7-13-21-30,31-22-14-8-15-23-31)32-24-16-9-17-25-32/h6-25,33-36,42H,26-28H2,1-5H3,(H,41,43)/t33-,34+,35?,36+/m0/s1
InChIKey XVDOZTDNBGFROD-KBHYPRPESA-N
Mol Weight 653.8 g/mol
Molecular Formula C40H47NO7
Exact Mass 653.335253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LccGDLv59Jj
Name 3-O-Benzyl-2-t-butyloxycarbonylamino-2-deoxy-5,6-O-isopropylidene-1-O-triphenylmethyl-D-glalacitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H47NO7
InChI InChI=1S/C40H47NO7/c1-38(2,3)48-37(43)41-33(36(44-26-29-18-10-6-11-19-29)35(42)34-28-45-39(4,5)47-34)27-46-40(30-20-12-7-13-21-30,31-22-14-8-15-23-31)32-24-16-9-17-25-32/h6-25,33-36,42H,26-28H2,1-5H3,(H,41,43)/t33-,34+,35?,36+/m0/s1
InChIKey XVDOZTDNBGFROD-KBHYPRPESA-N
Molecular Weight 653.816 g/mol
SMILES OC([C@@]([C@@](NC(OC(C)(C)C)=O)(COC(c1ccccc1)(c1ccccc1)c1ccccc1)[H])(OCc1ccccc1)[H])[C@@]1(OC(C)(C)OC1)[H]
SPLASH splash10-0006-0091000000-21ec9f1d8d5283ee419d
Source of Spectrum F-50-13308-17
Synonyms 3-O-benzyl-2-[(tert-butoxycarbonyl)amino]-2-deoxy-5,6-O-(1-methylethylidene)-1-O-trityl-D-xylo-hexitol [(1S,2R)-2-Benzyloxy-3-((R)-2,2-dimethyl-[1,3]dioxolan-4-yl)-3-hydroxy-1-trityloxymethyl-propyl]-carbamic acid tert-butyl ester
Wiley ID 790054