Debug Info

object
{24}
_id
:
6ccXbVPVV3C
compoundID
:
6ccXbVPVV3C
ambiguous
:
false
names
[0]
name
:
CRYPTOPHILIC_ACID_A;(+)-(3-S,12-S)-3,12-DIHYDROXYPALMITIC_ACID_12-O-{ALPHA-RHAMNOPYRANOSYL-(1->2)-O-BETA-GLUCOPYRANOSYL-(1->2)
ambiguousSiblings
[0]
hasStructure
:
true
recordSources
[1]
properties
{7}
spectrumSourcesMap
{1}
spectrumSourcesMapSuggestedOrder
[1]
otherEnantiomer1Compound
{1}
saltCompounds
[0]
isotopicCompounds
[0]
stereoisomerCompounds
[0]
stereoisomerSaltCompounds
[0]
similarCompounds
[10]
vendors
[0]
articles
[1]
lastUpdated
:
1735071411015
isDeprecated
:
false
productInfo
[0]
spectrumSourcesMapCountOriginal
:
1
spectrumSourcesMapCountFiltered
:
1

Logged In :

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  • ImageFullAxis
  • SearchSpectral
  • SearchStructure
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CRYPTOPHILIC_ACID_A;(+)-(3-S,12-S)-3,12-DIHYDROXYPALMITIC_ACID_12-O-{ALPHA-RHAMNOPYRANOSYL-(1->2)-O-BETA-GLUCOPYRANOSYL-(1->2)
SpectraBase Compound ID 6ccXbVPVV3C
InChI InChI=1S/C40H72O22/c1-4-5-13-21(14-11-9-7-6-8-10-12-20(42)15-24(43)44)58-39-35(32(52)28(48)23(60-39)17-55-37-33(53)29(49)25(45)18(2)56-37)62-40-36(31(51)27(47)22(16-41)59-40)61-38-34(54)30(50)26(46)19(3)57-38/h18-23,25-42,45-54H,4-17H2,1-3H3,(H,43,44)/t18-,19-,20-,21-,22+,23+,25-,26-,27+,28+,29+,30+,31-,32-,33+,34+,35+,36+,37+,38-,39+,40-/m0/s1
InChIKey JWKIOWGQARSDFT-FKJUYXGDSA-N
Mol Weight 905.0 g/mol
Molecular Formula C40H72O22
Exact Mass 904.451524 g/mol
Enantiomer InChIKey JWKIOWGQARSDFT-ZVPGWIOYSA-N
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