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: XXTAHAQGGBPUCT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4412131

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C33H56O3/c1-22(2)9-8-10-24(5)28-13-14-29-27-12-11-25-21-26(36-31(34)35-20-17-23(3)4)15-18-32(25,6)30(27)16-19-33(28,29)7/h11,22-24,26-30H,8-10,12-21H2,1-7H3
C33H56O3500.7959400000017400
10060128

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C33H56O3/c1-22(2)9-8-10-24(5)28-13-14-29-27-12-11-25-21-26(36-31(34)35-20-17-23(3)4)15-18-32(25,6)30(27)16-19-33(28,29)7/h11,22-24,26-30H,8-10,12-21H2,1-7H3/t24-,26-,27+,28-,29-,30+,32-,33+/m0/s1
C33H56O3500.79593200
10060130

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C33H56O3/c1-22(2)9-8-10-24(5)28-13-14-29-27-12-11-25-21-26(36-31(34)35-20-17-23(3)4)15-18-32(25,6)30(27)16-19-33(28,29)7/h11,22-24,26-30H,8-10,12-21H2,1-7H3/t24-,26-,27+,28+,29-,30+,32-,33+/m0/s1
C33H56O3500.79593200
10060129

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C33H56O3/c1-22(2)9-8-10-24(5)28-13-14-29-27-12-11-25-21-26(36-31(34)35-20-17-23(3)4)15-18-32(25,6)30(27)16-19-33(28,29)7/h11,22-24,26-30H,8-10,12-21H2,1-7H3/t24-,26+,27-,28-,29+,30-,32+,33-/m1/s1
C33H56O3500.79592100
10060127

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C33H56O3/c1-22(2)9-8-10-24(5)28-13-14-29-27-12-11-25-21-26(36-31(34)35-20-17-23(3)4)15-18-32(25,6)30(27)16-19-33(28,29)7/h11,22-24,26-30H,8-10,12-21H2,1-7H3/t24-,26+,27-,28+,29+,30-,32+,33-/m1/s1
C33H56O3500.79592100

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