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 7 results

Search term: FTUCJLKRCLNNPB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
353844

11 of 16 defined stereocentres - 11/16 defined
InChI=1/C37H58O11/c1-18-15-21(28(32(5,6)43)46-19(2)38)48-37(44)27(18)33(7)13-14-36-17-35(36)12-11-24(47-29-26(41)25(40)20(39)16-45-29)31(3,4)22(35)9-10-23(36)34(33,8)30(37)42/h10,18,20-22,24-30,39-44H,9,11-17H2,1-8H3/t18-,20?,21?,22+,24+,25?,26?,27-,28+,29?,30-,33-,34-,35-,36+,37-/m1/s1
C37H58O11678.84983100
8660083

15 of 16 defined stereocentres - 15/16 defined
InChI=1/C37H58O11/c1-18-15-21(28(32(5,6)43)46-19(2)38)48-37(44)27(18)33(7)13-14-36-17-35(36)12-11-24(47-29-26(41)25(40)20(39)16-45-29)31(3,4)22(35)9-10-23(36)34(33,8)30(37)42/h10,18,20-22,24-30,39-44H,9,11-17H2,1-8H3/t18-,20-,21-,22?,24+,25+,26-,27-,28+,29+,30-,33-,34-,35-,36+,37-/m1/s1
C37H58O11678.84982100
8707948

15 of 16 defined stereocentres - 15/16 defined
InChI=1/C37H58O11/c1-18-15-21(28(32(5,6)43)46-19(2)38)48-37(44)27(18)33(7)13-14-36-17-35(36)12-11-24(47-29-26(41)25(40)20(39)16-45-29)31(3,4)22(35)9-10-23(36)34(33,8)30(37)42/h10,18,20-22,24-30,39-44H,9,11-17H2,1-8H3/t18-,20+,21-,22?,24+,25+,26-,27-,28+,29+,30-,33-,34-,35-,36+,37-/m1/s1
C37H58O11678.84982100
8898539

15 of 16 defined stereocentres - 15/16 defined
InChI=1/C37H58O11/c1-18-15-21(28(32(5,6)43)46-19(2)38)48-37(44)27(18)33(7)13-14-36-17-35(36)12-11-24(47-29-26(41)25(40)20(39)16-45-29)31(3,4)22(35)9-10-23(36)34(33,8)30(37)42/h10,18,20-22,24-30,39-44H,9,11-17H2,1-8H3/t18-,20+,21-,22?,24+,25+,26-,27-,28-,29+,30-,33-,34-,35-,36+,37-/m1/s1
C37H58O11678.84982100
8969952

15 of 16 defined stereocentres - 15/16 defined
InChI=1/C37H58O11/c1-18-15-21(28(32(5,6)43)46-19(2)38)48-37(44)27(18)33(7)13-14-36-17-35(36)12-11-24(47-29-26(41)25(40)20(39)16-45-29)31(3,4)22(35)9-10-23(36)34(33,8)30(37)42/h10,18,20-22,24-30,39-44H,9,11-17H2,1-8H3/t18-,20-,21-,22?,24+,25+,26-,27-,28-,29+,30-,33-,34-,35-,36+,37-/m1/s1
C37H58O11678.84982100
129167957

16 of 16 defined stereocentres - 16/16 defined
InChI=1/C37H58O11/c1-18-15-21(28(32(5,6)43)46-19(2)38)48-37(44)27(18)33(7)13-14-36-17-35(36)12-11-24(47-29-26(41)25(40)20(39)16-45-29)31(3,4)22(35)9-10-23(36)34(33,8)30(37)42/h10,18,20-22,24-30,39-44H,9,11-17H2,1-8H3/t18-,20-,21+,22+,24+,25+,26-,27-,28-,29+,30-,33-,34-,35-,36+,37-/m1/s1
C37H58O11678.84981100

Advertisement