Matches any text strings used to describe a molecule.
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
Additional Filters

Found 19 results

Search term: FINGADBUNZWVLV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4943331

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7+,14-10+,15-11+,21-12+,22-16+/t23-,24-,25+,26-,27-,29-,30+/m0/s1
C30H48N2O4500.7131151000
5462

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)
C30H48N2O4500.71314200
4510299

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7-,14-10+,15-11+,21-12-,22-16-
C30H48N2O4500.71313300
4577885

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7+,14-10+,15-11+,21-12+,22-16+
C30H48N2O4500.71313200
58134389

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7+,14-10+,15-11+,21-12-,22-16+/t23-,24-,25+,26-,27-,29-,30+/m0/s1
C30H48N2O4500.71313300
79715605

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7-,14-10-,15-11-,21-12-,22-16-/t23-,24-,25+,26-,27-,29-,30+/m0/s1
C30H48N2O4500.71312200
65321850

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7+,14-10+,15-11+,21-12+,22-16+/t23-,24-,25+,26-,27?,29-,30+/m0/s1
C30H48N2O4500.71312200
5145528

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/t23-,24+,25+,26+,27-,29-,30+/m1/s1
C30H48N2O4500.71312100
8089574

Double-bond stereo

4 of 7 defined stereocentres - 4/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7+,14-10+,15-11+,21-12+,22-16+/t23?,24?,25-,26+,27?,29+,30-/m1/s1
C30H48N2O4500.71312100
10239230

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7+,14-10+,15-11+,21-12+,22-16+/t23-,24-,25+,26+,27-,29-,30+/m0/s1
C30H48N2O4500.71312200
21494040

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7-,14-10-,15-11-,21-12-,22-16-
C30H48N2O4500.71312100
26373638

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7-,14-10-,15-11-,21-12-,22-16-/t23-,24-,25+,26+,27-,29+,30+/m1/s1
C30H48N2O4500.71312200
57487239

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7-,14-10+,15-11+,21-12+,22-16-/t23-,24-,25+,26-,27-,29-,30+/m0/s1
C30H48N2O4500.71311100
4696805

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7+,14-10-,15-11-,21-12-,22-16-/t23-,24-,25+,26+,27-,29+,30+/m1/s1
C30H48N2O4500.71311100
68024519

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7-,14-10-,15-11-,21-12-,22-16-/t23-,24-,25-,26+,27+,29+,30-/m0/s1
C30H48N2O4500.71311100
74157975

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7+,14-10+,15-11+,21-12-,22-16+/t23-,24-,25?,26+,27-,29-,30+/m0/s1
C30H48N2O4500.71311100
78445319

Double-bond stereo

4 of 7 defined stereocentres - 4/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7?,14-10+,15-11+,21-12+,22-16+/t23?,24?,25-,26+,27?,29+,30-/m1/s1
C30H48N2O4500.71311100
58140089

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C30H48N2O4/c1-21-12-8-7-9-13-23(3)20-32-28(34)15-11-10-14-24(4)27(17-16-22(2)18-21)36-29-19-26(33)30(31-6)25(5)35-29/h7-8,10-12,14-16,23-27,29-31,33H,9,13,17-20H2,1-6H3,(H,32,34)/b8-7+,14-10+,15-11+,21-12-,22-16+/t23-,24-,25+,26+,27-,29+,30+/m1/s1
C30H48N2O4500.71311100

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