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 12 results

Search term: YCAZFHUABUMOIM (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9881420

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C32H45NO7/c1-6-27-21(4)12-13-31(40-27)17-25-16-24(39-31)11-10-20(3)14-19(2)8-7-9-23-18-37-29-28(33-36)22(5)15-26(30(34)38-25)32(23,29)35/h7-10,15,19,21,24-27,29,35-36H,6,11-14,16-18H2,1-5H3/b8-7+,20-10+,23-9+,33-28-/t19-,21-,24+,25-,26-,27+,29+,31+,32+/m0/s1
C32H45NO7555.70227600
73962420

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C32H45NO7/c1-6-27-21(4)12-13-31(40-27)17-25-16-24(39-31)11-10-20(3)14-19(2)8-7-9-23-18-37-29-28(33-36)22(5)15-26(30(34)38-25)32(23,29)35/h7-10,15,19,21,24-27,29,35-36H,6,11-14,16-18H2,1-5H3/b8-7+,20-10+,23-9+,33-28+/t19-,21-,24+,25-,26-,27+,29+,31+,32+/m0/s1
C32H45NO7555.70227600
34983551

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C32H45NO7/c1-6-27-21(4)12-13-31(40-27)17-25-16-24(39-31)11-10-20(3)14-19(2)8-7-9-23-18-37-29-28(33-36)22(5)15-26(30(34)38-25)32(23,29)35/h7-10,15,19,21,24-27,29,35-36H,6,11-14,16-18H2,1-5H3/b8-7+,20-10+,23-9+,33-28u/t19-,21-,24+,25-,26-,27+,29+,31+,32+/m0/s1
C32H45NO7555.70225700
49697287

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C32H45NO7/c1-6-27-21(4)12-13-31(40-27)17-25-16-24(39-31)11-10-20(3)14-19(2)8-7-9-23-18-37-29-28(33-36)22(5)15-26(30(34)38-25)32(23,29)35/h7-10,15,19,21,24-27,29,35-36H,6,11-14,16-18H2,1-5H3/b8-7-,20-10-,23-9-,33-28u/t19-,21-,24+,25-,26-,27+,29+,31+,32+/m0/s1
C32H45NO7555.70224300
7850037

Double-bond stereo

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C32H45NO7/c1-6-27-21(4)12-13-31(40-27)17-25-16-24(39-31)11-10-20(3)14-19(2)8-7-9-23-18-37-29-28(33-36)22(5)15-26(30(34)38-25)32(23,29)35/h7-10,15,19,21,24-27,29,35-36H,6,11-14,16-18H2,1-5H3/b8-7+,20-10+,23-9+,33-28-/t19-,21-,24+,25-,26?,27+,29+,31+,32+/m0/s1
C32H45NO7555.70222200
65322928

Double-bond stereo

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C32H45NO7/c1-6-27-21(4)12-13-31(40-27)17-25-16-24(39-31)11-10-20(3)14-19(2)8-7-9-23-18-37-29-28(33-36)22(5)15-26(30(34)38-25)32(23,29)35/h7-10,15,19,21,24-27,29,35-36H,6,11-14,16-18H2,1-5H3/b8-7+,20-10-,23-9+,33-28-/t19-,21-,24+,25-,26?,27+,29+,31+,32+/m0/s1
C32H45NO7555.70222200
114974157

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C32H45NO7/c1-6-27-21(4)12-13-31(40-27)17-25-16-24(39-31)11-10-20(3)14-19(2)8-7-9-23-18-37-29-28(33-36)22(5)15-26(30(34)38-25)32(23,29)35/h7-10,15,19,21,24-27,29,35-36H,6,11-14,16-18H2,1-5H3/b8-7-,20-10-,23-9-,33-28+/t19-,21-,24+,25-,26-,27+,29+,31+,32+/m0/s1
C32H45NO7555.70222200
115284896

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C32H45NO7/c1-6-27-21(4)12-13-31(40-27)17-25-16-24(39-31)11-10-20(3)14-19(2)8-7-9-23-18-37-29-28(33-36)22(5)15-26(30(34)38-25)32(23,29)35/h7-10,15,19,21,24-27,29,35-36H,6,11-14,16-18H2,1-5H3/b8-7-,20-10+,23-9-,33-28u/t19-,21-,24+,25-,26-,27+,29+,31+,32+/m0/s1
C32H45NO7555.70221100
111307870

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C32H45NO7/c1-6-27-21(4)12-13-31(40-27)17-25-16-24(39-31)11-10-20(3)14-19(2)8-7-9-23-18-37-29-28(33-36)22(5)15-26(30(34)38-25)32(23,29)35/h7-10,15,19,21,24-27,29,35-36H,6,11-14,16-18H2,1-5H3/b8-7-,20-10-,23-9-,33-28-/t19-,21-,24+,25-,26-,27+,29+,31+,32+/m0/s1
C32H45NO7555.70221100
65322771

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C32H45NO7/c1-6-27-21(4)12-13-31(40-27)17-25-16-24(39-31)11-10-20(3)14-19(2)8-7-9-23-18-37-29-28(33-36)22(5)15-26(30(34)38-25)32(23,29)35/h7-10,15,19,21,24-27,29,35-36H,6,11-14,16-18H2,1-5H3/b8-7+,20-10-,23-9+,33-28u/t19-,21-,24+,25-,26-,27+,29+,31+,32+/m0/s1
C32H45NO7555.70221100
32698160

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C32H45NO7/c1-6-27-21(4)12-13-31(40-27)17-25-16-24(39-31)11-10-20(3)14-19(2)8-7-9-23-18-37-29-28(33-36)22(5)15-26(30(34)38-25)32(23,29)35/h7-10,15,19,21,24-27,29,35-36H,6,11-14,16-18H2,1-5H3/b8-7-,20-10-,23-9-,33-28-/t19-,21-,24+,25-,26-,27+,29+,31-,32+/m0/s1
C32H45NO7555.70221100
34522559

Double-bond stereo

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C32H45NO7/c1-6-27-21(4)12-13-31(40-27)17-25-16-24(39-31)11-10-20(3)14-19(2)8-7-9-23-18-37-29-28(33-36)22(5)15-26(30(34)38-25)32(23,29)35/h7-10,15,19,21,24-27,29,35-36H,6,11-14,16-18H2,1-5H3/b8-7+,20-10+,23-9+,33-28-/t19-,21-,24+,25?,26-,27+,29+,31+,32+/m0/s1
C32H45NO7555.70221100

Advertisement