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 C1[C@@H](C[C@H]2[C@](C1)([C@@H]1[C@@H](CC2)[C@H]2[C@](CC1)([C@@H]1[C@H](C2)O[C@@]2([C@H]1C)[C@H]([C@@H]([C@H](CO2)C)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAgavaceaeAgave americana Ref.
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