input word = C00032247

Metabolite InformationStructural formula
Name Sublanceoside L6
(-)-Sublanceoside L6
Formula C61H96O24
Mw 1212.629154
CAS RN 923021-41-4
C_ID C00032247 ,
InChIKey RLGGUDAQMBDXLW-AEBBZHNZNA-N
InChICode InChI=1S/C61H96O24/c1-27-35(16-18-73-27)60(7)17-15-36-34(58(60)68)14-13-33-19-39(38(64)25-61(33,36)8)79-46-21-40(69-9)55(29(3)75-46)83-48-23-42(71-11)54(30(4)77-48)82-45-20-37(63)53(28(2)74-45)81-47-22-41(70-10)56(31(5)76-47)84-49-24-43(72-12)57(32(6)78-49)85-59-52(67)51(66)50(65)44(26-62)80-59/h13,16,18,28-32,34,36-57,59,62-67H,14-15,17,19-26H2,1-12H3/t28-,29-,30+,31-,32+,34-,36+,37+,38-,39-,40+,41+,42-,43-,44-,45+,46+,47+,48+,49+,50+,51+,52-,53-,54-,55-,56-,57+,59+,60-,61+/m1/s1
SMILES C1[C@@](C(=O)[C@H]2[C@H](C1)[C@@]1(C(=CC2)C[C@H]([C@@H](C1)O)O[C@@H]1O[C@@H]([C@H]([C@H](C1)OC)O[C@H]1C[C@H]([C@@H]([C@@H](O1)C)O[C@@H]1O[C@@H]([C@H]([C@H](C1)O)O[C@H]1C[C@@H]([C@@H]([C@H](O1)C)O[C@@H]1O[C@H]([C@@H]([C@@H](C1)OC)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)C)OC)C)OC)C)C)(c1c(occ1)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCynanchum sublanceolatum Ref.
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