Debug Info

object
{24}
_id
:
DJ06lcjRCHN
compoundID
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DJ06lcjRCHN
ambiguous
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false
names
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name
:
HERNIARIA-SAPONIN-1;3-O-BETA-GLUCURONOPYRANOSYL-MEDICAGENIC-ACID-28-O-[GLUCOPYRANOSYL-(1->3)-RHAMNOPYRANOSYL-(1->2)-(3,4-DIACETYL)-FUCOPYRANOSYL]-
ambiguousSiblings
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hasStructure
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true
recordSources
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properties
{7}
spectrumSourcesMap
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spectrumSourcesMapSuggestedOrder
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otherEnantiomer1Compound
{1}
saltCompounds
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isotopicCompounds
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stereoisomerCompounds
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stereoisomerSaltCompounds
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similarCompounds
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vendors
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articles
[1]
lastUpdated
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1735071411015
isDeprecated
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false
productInfo
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spectrumSourcesMapCountFiltered
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1

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SpectraBase Compound ID DJ06lcjRCHN
InChI InChI=1S/C58H88O27/c1-22-32(63)41(81-47-37(68)34(65)33(64)29(21-59)80-47)39(70)49(76-22)83-44-43(79-25(4)61)40(78-24(3)60)23(2)77-50(44)85-52(75)58-17-15-53(5,6)19-27(58)26-11-12-30-54(7)20-28(62)45(84-48-38(69)35(66)36(67)42(82-48)46(71)72)57(10,51(73)74)31(54)13-14-56(30,9)55(26,8)16-18-58/h11,22-23,27-45,47-50,59,62-70H,12-21H2,1-10H3,(H,71,72)(H,73,74)/t22-,23?,27?,28-,29+,30?,31?,32-,33+,34-,35-,36-,37+,38+,39+,40-,41+,42-,43-,44+,45-,47-,48-,49-,50-,54+,55+,56+,57-,58-/m0/s1
InChIKey BEESRPAJZAOREY-FKHZPZNJSA-N
Mol Weight 1217.3 g/mol
Molecular Formula C58H88O27
Exact Mass 1216.551298 g/mol
Enantiomer InChIKey BEESRPAJZAOREY-KRXNFRPNSA-N
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13',16':18',21'-dietheno-1,1''-diethyl-3',14',20',31'-tetramethyldispiro[piperidine-4,17'-[5,12,22,29]tetraoxa[37,40,41]triazatetracyclo[31.13.1.0.(4,45).0(30,35)]heptatetraconta-1',3',13',15',18',20',30',34',35',45'-decaene-47',4''-piperidine]-38',42'-dione
{(4a,5,6,7,7a-.eta.)-4-(2",2"-Dimethyl-1",3"-dioxolan-4"-yl)-3a,5,8,8a-tetrahydro-2,2-dimethyl-4H-indeno[5,6-d]-1,3-dioxol-5-yl}-{(4',5',6',7',7a'-.eta.)-5'-(chloromercurio)-4'-(2"',2"'-dimethyl-1'",3'"-dioxolan-4"'-yl}-3a',5',8',8a'-tetrahydro-2',2'-dimethyl-4H-indeno5,6-d]-1',3'-dioxol-5'-yl}- iron (II)
Cobalt, bis(cyano-C)(8,11-diethyl-2,3,3a,7,8,9,10,11,12,16,17,20a-dodecahydro-3a,5,8,9,12,14,17,17-octamethyl-7,12,16,20a-tetrapropyl-10,13-imino-4,20:9,16:18,15-trinitrilo-6H-cyclononadeca[b]furanato-N21,N22,N23,N24)-, stereoisomer
6H-Benzo[4,5]cyclodec[1,2-b]oxireno[c]furan, butanoic acid deriv.
2-Propenoic acid, 3-phenyl-, 1,1a,1b,1c,2a,3,3a,4,6a,6b,7,8-dodecahydro-3a,6b-dihydroxy-1,1,5,7-tetramethyl-4-oxo-2a-[[(1-oxo-3-phenyl-2-propenyl)oxy]methyl]-8aH-cyclopropa[5',6']benz[1',2':7,8]az uleno[5,6-b]oxirene-8,8a-diyl ester, [1aR-(1a.alpha.,1b.beta.,1c.beta.,2a.beta.,3a.beta.,6a.alpha.,6b.alpha.,7.alpha.,8.beta.,8a.alpha.)]-
Cobalt, bis(cyano-C)(8,11-diethyl-2,3,3a,7,8,9,10,11,12,16,17,20a-dodecahydro-3a,5,8,9,12,14,17,17-octamethyl-7,12,16,20a-tetrapropyl-10,13-imino-4,20:9,16:18,15-trinitrilo-6H-cyclononadeca[b]furanato-N21,N22,N23,N24)-, stereoisomer
(2S,5S*,7S*,9S,1-S,12R,13Z,15R)-2-[(2R,5R,6S)-5-Benzyloxy-5-ethyl-6-methyltetrahydropyran-2-yl]-9-[(R)-1-ethyl-2-oxobutyl]-15-(4-methoxybenzyloxy)-2,10,12-trimethyl-1,6,8-trioxadispiro[4.1.3.5]pentadec-13-ene
21H,23H-Porphine-2,18-dipropanoic acid, 7,12-bis[1-[1-[ethenyl-2,18-bis(3-methoxy-3-oxopropyl)-3,17,?,?-tetramethyl-21H,23H-porphinyl]ethoxy]ethyl]-3,8,13,17-tetramethyl-, dimethyl ester
4H-9,12:15,18-Dietheno-28,31-imino-26,23-methenopyrrolo[2,3-n][1,19,6]dioxaazacyclohentriacontine-6,21,24(5H,22H,25H)-trione, 30-ethyl-2-[(3-ethyl-1,5-dihydro-4-methyl-5-oxo-2H-pyrrol-2-ylidene)methyl]-8,13,14,19-tetrahydro-3,29,34-trimethyl-, (Z,Z,Z)-
Nickel, (4,4,5,5,9,9,10,10,14,14,15,15,19,19,20,20-hexadecamethyl-21,27-dioxa -2,12,28,29,30,31-hexaazahexacyclo[9.9.7.1(1,18).1(3,6).1(8,11).1(13,16)]hentriaconta-2,6(31),7,12,16(29),17-hexaenato(2-)-N28,N29,N30,N31)-, (SP-4-1)-
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