| Name |
Chlorogenic acid methyl ester
Methyl 5-O-caffeoylquinate
Methyl chlorogenate |
| Formula |
C17H20O9 |
| Mw |
368.11073224 |
| CAS RN |
29708-87-0 |
| C_ID |
C00029948
, 
|
| InChIKey |
MZNIJRAPCCELQX-BADWVSBWNA-N |
| InChICode |
InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1 |
| SMILES |
C1[C@H]([C@H]([C@@H](C[C@@]1(C(=O)OC)O)OC(=O)/C=C/c1cc(c(cc1)O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Animalia | Bovidae | Bos taurus domesticus GMELIN  | Ref. |
| Bacteria | Myroidaceae | Myroides sp. SM1 | Ref. |
| Fungi | Trichocomaceae | Penicillium sp. SA29 | Ref. |
| Plantae | Apocynaceae | Trachelospermum asiaticum var.intermedium | Ref. |
| Plantae | Asteraceae | Saussurea medusa | Ref. |
| Plantae | Eucommiaceae | Eucommia ulmoides | Ref. |
| Plantae | Rubiaceae | Adina racemosa | Ref. |
| Plantae | Rubiaceae | Sinoadina Racemosa | Ref. |
| Plantae | Sapotaceae | Manilkara zapota cv.Tikal | Ref. |
| Plantae | Vittariaceae | Vittaria anguste-elongata | Ref. |
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