input word = C00042035

Metabolite InformationStructural formula
Name 10-O-cis-p-Coumaroyldesacetyl asperulosidic acid
(-)-10-O-cis-p-Coumaroyldesacetyl asperulosidic acid
Formula C25H28O13
Mw 536.15299098
CAS RN 870785-28-7
C_ID C00042035 ,
InChIKey AENHXJZDACLRQM-CZOHLIPYNA-N
InChICode InChI=1S/C25H28O13/c26-8-16-20(30)21(31)22(32)25(37-16)38-24-18-12(7-15(28)19(18)14(10-36-24)23(33)34)9-35-17(29)6-3-11-1-4-13(27)5-2-11/h1-7,10,15-16,18-22,24-28,30-32H,8-9H2,(H,33,34)/b6-3-/t15-,16-,18-,19+,20-,21+,22-,24+,25+/m1/s1
SMILES O=C(/C=Cc1ccc(O)cc1)OCC1=C[C@H](O)[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEricaceaeCraibiodendron henryi Ref.
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