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Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
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Single/Multi-component
Isotopically Labeled
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Found 3 results

Search term: C38H44O20 (Found by molecular formula)
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8852233

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C38H44O20/c1-19(39)51-16-28-32(46)34(48)35(54-21(3)41)37(55-28)58-38(18-53-20(2)40)36(56-31(45)13-9-23-7-11-25(43)27(15-23)50-5)33(47)29(57-38)17-52-30(44)12-8-22-6-10-24(42)26(14-22)49-4/h6-15,28-29,32-37,42-43,46-48H,16-18H2,1-5H3/b12-8+,13-9+/t28-,29-,32-,33-,34+,35-,36+,37+,38+/m1/s1
C38H44O20820.7442100
8947043

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C38H44O20/c1-19(40)51-17-29-34(53-20(2)41)33(48)35(54-21(3)42)37(55-29)58-38(18-39)36(56-31(46)13-9-23-7-11-25(44)27(15-23)50-5)32(47)28(57-38)16-52-30(45)12-8-22-6-10-24(43)26(14-22)49-4/h6-15,28-29,32-37,39,43-44,47-48H,16-18H2,1-5H3/b12-8+,13-9+/t28-,29-,32-,33+,34-,35-,36+,37+,38+/m1/s1
C38H44O20820.7442100
10145837

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C38H44O20/c1-19(40)51-17-29-34(53-20(2)41)33(48)35(54-21(3)42)37(55-29)58-38(18-39)36(56-31(46)13-9-23-7-11-25(44)27(15-23)50-5)32(47)28(57-38)16-52-30(45)12-8-22-6-10-24(43)26(14-22)49-4/h6-15,28-29,32-37,39,43-44,47-48H,16-18H2,1-5H3/b12-8+,13-9+/t28-,29-,32+,33-,34-,35-,36+,37-,38+/m1/s1
C38H44O20820.7442200

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