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 4 results

Search term: UNCBZODCSVGKDO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
24621518

Double-bond stereo

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C29H34O10/c1-15-21(38-16(2)31)13-20-19(24(15)34)11-10-17-12-18(8-6-4-5-7-9-23(32)33)29(26(36)28(17,20)3)25(35)22(14-30)39-27(29)37/h4-11,15,17-22,24,30,34H,12-14H2,1-3H3,(H,32,33)/b5-4+,8-6+,9-7+/t15-,17-,18+,19+,20-,21+,22-,24+,28-,29-/m0/s1
C29H34O10542.57432200
59700989

Double-bond stereo

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C29H34O10/c1-15-21(38-16(2)31)13-20-19(24(15)34)11-10-17-12-18(8-6-4-5-7-9-23(32)33)29(26(36)28(17,20)3)25(35)22(14-30)39-27(29)37/h4-11,15,17-22,24,30,34H,12-14H2,1-3H3,(H,32,33)/b5-4+,8-6+,9-7+/t15-,17+,18-,19?,20+,21-,22-,24-,28+,29-/m1/s1
C29H34O10542.57432100
78439777

Double-bond stereo

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C29H34O10/c1-15-21(38-16(2)31)13-20-19(24(15)34)11-10-17-12-18(8-6-4-5-7-9-23(32)33)29(26(36)28(17,20)3)25(35)22(14-30)39-27(29)37/h4-11,15,17-22,24,30,34H,12-14H2,1-3H3,(H,32,33)/b5-4+,8-6u,9-7+/t15-,17-,18+,19+,20-,21+,22?,24+,28-,29-/m0/s1
C29H34O10542.57431100
17253176

Double-bond stereo

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C29H34O10/c1-15-21(38-16(2)31)13-20-19(24(15)34)11-10-17-12-18(8-6-4-5-7-9-23(32)33)29(26(36)28(17,20)3)25(35)22(14-30)39-27(29)37/h4-11,15,17-22,24,30,34H,12-14H2,1-3H3,(H,32,33)/b5-4+,8-6+,9-7+/t15-,17-,18+,19+,20-,21+,22?,24+,28-,29?/m0/s1
C29H34O10542.57431100

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