input word = C00048336

Metabolite InformationStructural formula
Name Blechnoside B
Formula C33H54O10
Mw 610.37169795
CAS RN 104387-06-6
C_ID C00048336 ,
InChIKey OVBHAHZBRSIVHE-CEQBPCPWNA-N
InChICode InChI=1S/C33H54O10/c1-17(23(36)9-10-30(2,3)43-29-28(40)27(39)26(38)25(16-34)42-29)19-8-13-33(41)21-15-24(37)22-14-18(35)6-11-31(22,4)20(21)7-12-32(19,33)5/h15,17-20,22-23,25-29,34-36,38-41H,6-14,16H2,1-5H3/t17-,18-,19+,20-,22-,23+,25+,26+,27-,28+,29-,31+,32+,33+/m0/s1
SMILES C1[C@H]2C(=CC(=O)[C@H]3[C@@]2(CC[C@@H](C3)O)C)[C@]2([C@](C1)([C@H](CC2)[C@@H]([C@@H](CCC(O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)(C)C)O)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAmaranthaceaeFroelichia floridana Ref.
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