input word = C00030620

Metabolite InformationStructural formula
Name Kingianoside F
Formula C51H84O25
Mw 1096.53016824
CAS RN 913176-36-0
C_ID C00030620 ,
InChIKey UPVLYUWJHDSLLG-GETCHWKQNA-N
InChICode InChI=1S/C51H84O25/c1-19(18-68-45-40(64)36(60)33(57)27(14-52)70-45)7-10-51(67)20(2)32-26(76-51)13-25-23-6-5-21-11-22(12-31(56)50(21,4)24(23)8-9-49(25,32)3)69-46-42(66)39(63)43(30(17-55)73-46)74-48-44(38(62)35(59)29(16-54)72-48)75-47-41(65)37(61)34(58)28(15-53)71-47/h5,19-20,22-48,52-67H,6-18H2,1-4H3/t19-,20+,22-,23-,24+,25+,26+,27-,28-,29-,30-,31-,32+,33-,34-,35-,36+,37+,38+,39-,40-,41-,42-,43-,44-,45-,46-,47+,48+,49+,50+,51-/m1/s1
SMILES C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2([C@@H]1O)C)CC[C@]1([C@H]3C[C@H]2[C@@H]1[C@@H]([C@](O2)(CC[C@H](CO[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)C)O)C)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeConvallariaceaePolygonatum kingianum COLL.et HEMSL. Ref.
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