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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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Isotopically Labeled
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Found 60 results

Search term: C25H48O5 (Found by molecular formula)
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9277177

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C25H48O5/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(30-25(4,5)28-20)22(26)21-19-27-24(2,3)29-21/h20-23,26H,6-19H2,1-5H3/t20-,21-,22-,23-/m1/s1
C25H48O5428.6456191700
550365

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C25H48O5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(29-22(2)26)19-27-20-24-21-28-25(3,4)30-24/h23-24H,5-21H2,1-4H3
C25H48O5428.64565500
5254059

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C25H48O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(28)30-22-24(27)21-29-23(2)26/h24,27H,3-22H2,1-2H3
C25H48O5428.64565500
467984

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C25H48O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28-21-25(30-24(3)27)22-29-23(2)26/h25H,4-22H2,1-3H3
C25H48O5428.64564500
74857963

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H48O5/c1-3-5-7-9-10-11-12-13-14-16-18-20-25(28)30-23(21-26)22-29-24(27)19-17-15-8-6-4-2/h23,26H,3-22H2,1-2H3/t23-/m0/s1
C25H48O5428.64563300
74857964

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H48O5/c1-4-5-6-11-15-18-24(27)29-21-23(20-26)30-25(28)19-16-13-10-8-7-9-12-14-17-22(2)3/h22-23,26H,4-21H2,1-3H3/t23-/m0/s1
C25H48O5428.64563300
74857986

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H48O5/c1-3-5-7-9-11-12-14-16-18-20-25(28)30-23(21-26)22-29-24(27)19-17-15-13-10-8-6-4-2/h23,26H,3-22H2,1-2H3/t23-/m0/s1
C25H48O5428.64563300
74857987

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H48O5/c1-4-5-6-7-8-12-15-18-24(27)29-21-23(20-26)30-25(28)19-16-13-10-9-11-14-17-22(2)3/h22-23,26H,4-21H2,1-3H3/t23-/m0/s1
C25H48O5428.64563300
74858015

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H48O5/c1-3-5-7-9-11-12-14-15-17-19-24(27)29-22-23(21-26)30-25(28)20-18-16-13-10-8-6-4-2/h23,26H,3-22H2,1-2H3/t23-/m0/s1
C25H48O5428.64562200
74858016

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H48O5/c1-4-5-6-7-8-13-16-19-25(28)30-23(20-26)21-29-24(27)18-15-12-10-9-11-14-17-22(2)3/h22-23,26H,4-21H2,1-3H3/t23-/m0/s1
C25H48O5428.64562200
74858155

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H48O5/c1-3-5-7-9-10-11-12-13-14-16-17-19-24(27)29-22-23(21-26)30-25(28)20-18-15-8-6-4-2/h23,26H,3-22H2,1-2H3/t23-/m0/s1
C25H48O5428.64562200
74858156

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H48O5/c1-4-5-6-11-16-19-25(28)30-23(20-26)21-29-24(27)18-15-13-10-8-7-9-12-14-17-22(2)3/h22-23,26H,4-21H2,1-3H3/t23-/m0/s1
C25H48O5428.64562200
8821572

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C25H48O5/c1-3-4-5-6-7-8-9-10-11-14-17-24(29-21-28-2)25-19-18-23(30-25)22(27)16-13-12-15-20-26/h12,15,22-27H,3-11,13-14,16-21H2,1-2H3/b15-12+/t22-,23-,24+,25-/m1/s1
C25H48O5428.64562100
9147219

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C25H48O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22-17-19-24(30-22)23(27)18-16-21(26)20-25(28)29-2/h21-24,26-27H,3-20H2,1-2H3/t21-,22-,23-,24+/m0/s1
C25H48O5428.64562100
59694828

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H48O5/c1-4-5-6-11-15-18-24(27)29-20-23(26)21-30-25(28)19-16-13-10-8-7-9-12-14-17-22(2)3/h22-23,26H,4-21H2,1-3H3/t23-/m0/s1
C25H48O5428.64562300
59695667

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C25H48O5/c1-3-5-7-9-11-12-14-16-18-20-25(28)30-23(21-26)22-29-24(27)19-17-15-13-10-8-6-4-2/h23,26H,3-22H2,1-2H3
C25H48O5428.64562200
59695672

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C25H48O5/c1-3-5-7-9-11-12-14-15-17-19-24(27)29-22-23(21-26)30-25(28)20-18-16-13-10-8-6-4-2/h23,26H,3-22H2,1-2H3
C25H48O5428.64562200
61711319

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H48O5/c1-3-5-7-8-9-10-11-12-13-14-15-16-18-19-24(27)29-22-23(21-26)30-25(28)20-17-6-4-2/h23,26H,3-22H2,1-2H3/t23-/m0/s1
C25H48O5428.64562800
61712067

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C25H48O5/c1-3-5-7-9-11-13-15-17-19-24(27)29-22-23(21-26)30-25(28)20-18-16-14-12-10-8-6-4-2/h23,26H,3-22H2,1-2H3/t23-/m0/s1
C25H48O5428.64562300
123

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