Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LMFW58
|
|||
| Ligand Name |
Platencin A1
|
|||
| Synonyms |
Platencin A1; CHEBI:68249; DTXSID501099615; hthalen-8-yl]propanoyl}amino)benzoic acid; Q27136742; 1186428-91-0; 2,4-dihydroxy-3-({3-[(2R,4aR,8S,8aR,9R)-9-hydroxy-8-methyl-3-methylidene-7-oxo-1,3,4,7,8,8a-hexahydro-2H-2,4a-ethanonap hthalen-8-yl]propanoyl}amino)benzoic acid; 2,4-dihydroxy-3-({3-[(2R,4aR,8S,8aR,9R)-9-hydroxy-8-methyl-3-methylidene-7-oxo-1,3,4,7,8,8a-hexahydro-2H-2,4a-ethanonaphthalen-8-yl]propanoyl}amino)benzoic acid; 3-[[3-[(2R,4aR,8S,8aR,9R)-1,3,4,7,8,8a-Hexahydro-9-hydroxy-8-methyl-3-methylene-7-oxo-2H-2,4a-ethanonaphthalen-8-yl]-1-oxopropyl]amino]-2,4-dihydroxybenzoic acid; N3A
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C24H27NO7
|
|||
| Canonical SMILES |
CC1(C2CC3CC(C2(CC3=C)C=CC1=O)O)CCC(=O)NC4=C(C=CC(=C4O)C(=O)O)O
|
|||
| InChI |
1S/C24H27NO7/c1-12-11-24-8-5-17(27)23(2,16(24)9-13(12)10-18(24)28)7-6-19(29)25-20-15(26)4-3-14(21(20)30)22(31)32/h3-5,8,13,16,18,26,28,30H,1,6-7,9-11H2,2H3,(H,25,29)(H,31,32)/t13-,16+,18-,23+,24+/m1/s1
|
|||
| InChIKey |
KCPPASJQWABQQM-XLJNEENLSA-N
|
|||
| PubChem Compound ID | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.