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 5 results

Search term: BNCZLSHZKVRXSH (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3557978

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C33H56O3/c1-8-23(4)21-35-31(34)36-26-16-18-32(6)25(20-26)12-13-27-29-15-14-28(24(5)11-9-10-22(2)3)33(29,7)19-17-30(27)32/h12,22-24,26-30H,8-11,13-21H2,1-7H3
C33H56O3500.7959400000017400
10060134

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C33H56O3/c1-8-23(4)21-35-31(34)36-26-16-18-32(6)25(20-26)12-13-27-29-15-14-28(24(5)11-9-10-22(2)3)33(29,7)19-17-30(27)32/h12,22-24,26-30H,8-11,13-21H2,1-7H3/t23-,24-,26-,27-,28+,29+,30+,32-,33-/m0/s1
C33H56O3500.79593200
10060131

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C33H56O3/c1-8-23(4)21-35-31(34)36-26-16-18-32(6)25(20-26)12-13-27-29-15-14-28(24(5)11-9-10-22(2)3)33(29,7)19-17-30(27)32/h12,22-24,26-30H,8-11,13-21H2,1-7H3/t23-,24+,26-,27+,28-,29-,30-,32+,33+/m1/s1
C33H56O3500.79592100
10060132

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C33H56O3/c1-8-23(4)21-35-31(34)36-26-16-18-32(6)25(20-26)12-13-27-29-15-14-28(24(5)11-9-10-22(2)3)33(29,7)19-17-30(27)32/h12,22-24,26-30H,8-11,13-21H2,1-7H3/t23-,24-,26+,27-,28+,29+,30+,32-,33-/m0/s1
C33H56O3500.79592100
10060133

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C33H56O3/c1-8-23(4)21-35-31(34)36-26-16-18-32(6)25(20-26)12-13-27-29-15-14-28(24(5)11-9-10-22(2)3)33(29,7)19-17-30(27)32/h12,22-24,26-30H,8-11,13-21H2,1-7H3/t23-,24+,26+,27+,28-,29-,30-,32+,33+/m1/s1
C33H56O3500.79592100

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