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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
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
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Found 33 results

Search term: C44H78NO10P (Found by molecular formula)
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
24823091

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h11,13,17,19,22,24,28,30,40-41H,3-10,12,14-16,18,20-21,23,25-27,29,31-39,45H2,1-2H3,(H,48,49)(H,50,51)/b13-11-,19-17-,24-22-,30-28-/t40-,41+/m1/s1
C44H78NO10P812.0646111200
35032482

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h11,13,17-19,21-22,24,40-41H,3-10,12,14-16,20,23,25-39,45H2,1-2H3,(H,48,49)(H,50,51)/b13-11-,19-17-,21-18-,24-22-/t40-,41+/m1/s1
C44H78NO10P812.06469900
35032510

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-42(46)52-37-40(38-53-56(50,51)54-39-41(45)44(48)49)55-43(47)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h11,13,17-19,21-23,40-41H,3-10,12,14-16,20,24-39,45H2,1-2H3,(H,48,49)(H,50,51)/b13-11-,19-17-,21-18-,23-22-/t40-,41+/m1/s1
C44H78NO10P812.06469900
35032520

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-42(46)52-37-40(38-53-56(50,51)54-39-41(45)44(48)49)55-43(47)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h11,13,17,19,22-23,27,29,40-41H,3-10,12,14-16,18,20-21,24-26,28,30-39,45H2,1-2H3,(H,48,49)(H,50,51)/b13-11-,19-17-,23-22-,29-27-/t40-,41+/m1/s1
C44H78NO10P812.06469900
24768056

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,22,24,40-41H,3-4,6,8-10,12,14-16,18,20-21,23,25-39,45H2,1-2H3,(H,48,49)(H,50,51)/b7-5-,13-11-,19-17-,24-22-/t40-,41+/m1/s1
C44H78NO10P812.06469900
74876234

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-25-27-29-31-33-35-42(46)52-37-40(38-53-56(50,51)54-39-41(45)44(48)49)55-43(47)36-34-32-30-28-26-23-16-14-12-10-8-6-4-2/h11,13,17-18,20-21,24-25,40-41H,3-10,12,14-16,19,22-23,26-39,45H2,1-2H3,(H,48,49)(H,50,51)/b13-11-,18-17-,21-20-,25-24-/t40-,41+/m1/s1
C44H78NO10P812.06464400
74875796

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h11,13,17-18,20-21,24,26,40-41H,3-10,12,14-16,19,22-23,25,27-39,45H2,1-2H3,(H,48,49)(H,50,51)/b13-11-,18-17-,21-20-,26-24-/t40-,41+/m1/s1
C44H78NO10P812.06464400
74875874

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h11-14,17-19,21,40-41H,3-10,15-16,20,22-39,45H2,1-2H3,(H,48,49)(H,50,51)/b13-11-,14-12-,19-17-,21-18-/t40-,41+/m1/s1
C44H78NO10P812.06464400
74875898

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h12,14,17-19,21,25,27,40-41H,3-11,13,15-16,20,22-24,26,28-39,45H2,1-2H3,(H,48,49)(H,50,51)/b14-12-,19-17-,21-18-,27-25-/t40-,41+/m1/s1
C44H78NO10P812.06464400
74875915

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h6,8,12,14,17-19,21,40-41H,3-5,7,9-11,13,15-16,20,22-39,45H2,1-2H3,(H,48,49)(H,50,51)/b8-6-,14-12-,19-17-,21-18-/t40-,41+/m1/s1
C44H78NO10P812.06464400
74875940

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h6,8,12,14,18,21,25,27,40-41H,3-5,7,9-11,13,15-17,19-20,22-24,26,28-39,45H2,1-2H3,(H,48,49)(H,50,51)/b8-6-,14-12-,21-18-,27-25-/t40-,41+/m1/s1
C44H78NO10P812.06464400
74875965

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-42(46)52-37-40(38-53-56(50,51)54-39-41(45)44(48)49)55-43(47)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h6,8,12,14,18,21,26,28,40-41H,3-5,7,9-11,13,15-17,19-20,22-25,27,29-39,45H2,1-2H3,(H,48,49)(H,50,51)/b8-6-,14-12-,21-18-,28-26-/t40-,41+/m1/s1
C44H78NO10P812.06464400
74875992

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-42(46)52-37-40(38-53-56(50,51)54-39-41(45)44(48)49)55-43(47)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h12,14,17-19,21,26,28,40-41H,3-11,13,15-16,20,22-25,27,29-39,45H2,1-2H3,(H,48,49)(H,50,51)/b14-12-,19-17-,21-18-,28-26-/t40-,41+/m1/s1
C44H78NO10P812.06464400
74875993

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-42(46)52-37-40(38-53-56(50,51)54-39-41(45)44(48)49)55-43(47)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h6,8,12,14,17-19,21,40-41H,3-5,7,9-11,13,15-16,20,22-39,45H2,1-2H3,(H,48,49)(H,50,51)/b8-6-,14-12-,19-17-,21-18-/t40-,41+/m1/s1
C44H78NO10P812.06464400
74876018

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-42(46)52-37-40(38-53-56(50,51)54-39-41(45)44(48)49)55-43(47)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h11-14,17-19,21,40-41H,3-10,15-16,20,22-39,45H2,1-2H3,(H,48,49)(H,50,51)/b13-11-,14-12-,19-17-,21-18-/t40-,41+/m1/s1
C44H78NO10P812.06464400
74876042

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-42(46)52-37-40(38-53-56(50,51)54-39-41(45)44(48)49)55-43(47)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h14,16-17,19,22-23,27,29,40-41H,3-13,15,18,20-21,24-26,28,30-39,45H2,1-2H3,(H,48,49)(H,50,51)/b16-14-,19-17-,23-22-,29-27-/t40-,41+/m1/s1
C44H78NO10P812.06463300
74876043

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-42(46)52-37-40(38-53-56(50,51)54-39-41(45)44(48)49)55-43(47)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h17-19,21-23,27,29,40-41H,3-16,20,24-26,28,30-39,45H2,1-2H3,(H,48,49)(H,50,51)/b19-17-,21-18-,23-22-,29-27-/t40-,41+/m1/s1
C44H78NO10P812.06463300
74876065

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-42(46)52-37-40(38-53-56(50,51)54-39-41(45)44(48)49)55-43(47)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h11,13-14,16-17,19,22-23,40-41H,3-10,12,15,18,20-21,24-39,45H2,1-2H3,(H,48,49)(H,50,51)/b13-11-,16-14-,19-17-,23-22-/t40-,41+/m1/s1
C44H78NO10P812.06463300
74876102

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-42(46)52-37-40(38-53-56(50,51)54-39-41(45)44(48)49)55-43(47)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,22-23,40-41H,3-4,6,8-10,12,14-16,18,20-21,24-39,45H2,1-2H3,(H,48,49)(H,50,51)/b7-5-,13-11-,19-17-,23-22-/t40-,41+/m1/s1
C44H78NO10P812.06463300
74875838

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h14,16-17,19,22,24,28,30,40-41H,3-13,15,18,20-21,23,25-27,29,31-39,45H2,1-2H3,(H,48,49)(H,50,51)/b16-14-,19-17-,24-22-,30-28-/t40-,41+/m1/s1
C44H78NO10P812.06463300
12

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