input word = C00031569

Metabolite InformationStructural formula
Name Agamenoside I:(-)-Agamenoside I
Formula C33H54O10
Mw 610.37169795
CAS RN 738584-20-8
C_ID C00031569 ,
InChIKey FSAWPTNNGNWEDC-CKDQDIDQNA-N
InChICode InChI=1S/C33H54O10/c1-15-14-40-33(29(39)28(15)42-30-27(38)26(37)25(36)23(13-34)41-30)16(2)24-22(43-33)12-21-19-6-5-17-11-18(35)7-9-31(17,3)20(19)8-10-32(21,24)4/h15-30,34-39H,5-14H2,1-4H3/t15-,16-,17-,18-,19+,20-,21-,22-,23+,24-,25-,26-,27+,28+,29-,30-,31-,32-,33-/m0/s1
SMILES C[C@H]1CO[C@@]2(O[C@H]3C[C@H]4[C@@H]5CC[C@H]6C[C@@H](O)CC[C@]6(C)[C@H]5CC[C@]4(C)[C@H]3[C@@H]2C)[C@@H](O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAgavaceaeAgave americana Ref.
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