Debug Info

object
{24}
_id
:
Da5jgRup0Vw
compoundID
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Da5jgRup0Vw
ambiguous
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false
names
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name
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3,4,6-TRI-O-ACETYL-2-DEOXY-2-TRICHLOROACETAMIDO-D-GLUCOPYRANOSYL-BETA-(1->3)-1,4,5,6-TETRA-O-BENZOYL-D-CHIRO-INOSITOL
ambiguousSiblings
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hasStructure
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recordSources
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properties
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otherEnantiomer1Compound
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saltCompounds
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stereoisomerCompounds
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similarCompounds
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lastUpdated
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1735071411015
isDeprecated
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productInfo
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3,4,6-TRI-O-ACETYL-2-DEOXY-2-TRICHLOROACETAMIDO-D-GLUCOPYRANOSYL-BETA-(1->3)-1,4,5,6-TETRA-O-BENZOYL-D-CHIRO-INOSITOL
SpectraBase Compound ID Da5jgRup0Vw
InChI InChI=1S/C48H44Cl3NO18/c1-25(53)62-24-32-35(63-26(2)54)36(64-27(3)55)33(52-47(61)48(49,50)51)46(65-32)70-38-34(56)37(66-42(57)28-16-8-4-9-17-28)39(67-43(58)29-18-10-5-11-19-29)41(69-45(60)31-22-14-7-15-23-31)40(38)68-44(59)30-20-12-6-13-21-30/h4-23,32-41,46,56H,24H2,1-3H3,(H,52,61)/t32-,33-,34+,35-,36-,37-,38-,39+,40-,41-,46+/m0/s1
InChIKey WEKLULDWTBZBKP-YGYUVNKXSA-N
Mol Weight 1029.2 g/mol
Molecular Formula C48H44Cl3NO18
Exact Mass 1027.162397 g/mol
Enantiomer InChIKey WEKLULDWTBZBKP-WXRDUDCFSA-N
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