input word = C00036501

Metabolite InformationStructural formula
Name O-Apiosylverbascoside
2''-O-beta-Apiosylverbascoside
Formula C34H44O19
Mw 756.24767923
CAS RN 366018-57-7
C_ID C00036501 ,
InChIKey UXPCJXXUGGXVGI-UTXKKSDQNA-N
InChICode InChI=1S/C34H44O19/c1-15-24(42)25(43)26(44)31(49-15)52-28-27(51-23(41)7-4-16-2-5-18(37)20(39)10-16)22(12-35)50-32(47-9-8-17-3-6-19(38)21(40)11-17)29(28)53-33-30(45)34(46,13-36)14-48-33/h2-7,10-11,15,22,24-33,35-40,42-46H,8-9,12-14H2,1H3/b7-4+/t15-,22+,24-,25+,26+,27+,28-,29+,30-,31-,32+,33-,34+/m0/s1
SMILES C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](OCCc3ccc(O)c(O)c3)O[C@H](CO)[C@H]2OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBignoniaceaeBarnettia kerrii Ref.
PlantaeBignoniaceaeFernandoa adenophylla Ref.
PlantaeBignoniaceaeMarkhamia stipulata Ref.
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