Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
B4WG8B
|
|||
| Binder Name |
Neochlorogenic acid
|
|||
| Synonyms |
Neochlorogenate; UNII-O4601UER1Z; trans-Neochlorogenic acid; 5-O-(trans-3,4-Dihydroxycinnamoyl)-D-quinic acid; 5-O-Caffeoylquinic acid; CHEMBL249450; O4601UER1Z; trans-5-O-caffeoyl-D-quinic acid; MFCD10566639; trans-5-O-Caffeoylquinic acid; caffeoylquinic acid; trans-5-O-caffeoyl-D-quinate; 5-Caffeoylquinic acid; 5-Caffeylquinic acid; 5-O-caffeoyl quinic acid; 5-CQA; Nochlorogenic acid; Neochlorogenic-acid; EINECS 212-997-1; Quinic acid, 5-caffeoyl-, E-; SCHEMBL13567302; SCHEMBL18317299; ACon1_000392; HMS3886H18; HY-N0722; ZINC4096248; BDBM50163308; s9136; AKOS015901853; AC-6061; CCG-268077; CS-3770; MCULE-1539064371; Neochlorogenic acid, analytical standard; NCGC00169121-01; AS-75008; SC-17415; V1507; C17147; 906N332; Q-100887; Q6992128; 656B3E48-4F1F-4FC8-A3B2-B0FADAB84AF5; Neochlorogenic acid, from Lonicera japonica, >=98.0% (HPLC)
Click to Show/Hide
|
|||
| Binder Type |
Small molecular drug
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C16H18O9
|
|||
| Canonical SMILES |
C1[C@H]([C@@H]([C@@H](C[C@]1(C(=O)O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)O
|
|||
| InChI |
1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m1/s1
|
|||
| InChIKey |
CWVRJTMFETXNAD-NXLLHMKUSA-N
|
|||
| PubChem Compound ID | ||||
| ChEBI ID |
CHEBI:16384
|
|||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.