input word = C00033431

Metabolite InformationStructural formula
Name Telosmoside A3
(-)-Telosmoside A3
Formula C61H102O27
Mw 1266.66084806
CAS RN 343781-62-4
C_ID C00033431 ,
InChIKey XJGCRJAXHOCFSW-FZBPFLHUNA-N
InChICode InChI=1S/C61H102O27/c1-13-26(2)54(71)80-30(6)60(72)18-19-61(73)34-15-14-32-20-33(16-17-58(32,8)35(34)21-40(59(60,61)9)81-31(7)64)82-41-22-36(74-10)49(27(3)77-41)85-42-23-37(75-11)50(28(4)78-42)86-57-48(70)53(76-12)51(29(5)79-57)87-56-47(69)45(67)52(39(25-63)84-56)88-55-46(68)44(66)43(65)38(24-62)83-55/h26-30,32-53,55-57,62-63,65-70,72-73H,13-25H2,1-12H3/t26-,27+,28+,29+,30-,32-,33-,34+,35-,36-,37-,38+,39+,40+,41+,42-,43+,44-,45+,46+,47+,48+,49+,50+,51+,52+,53+,55-,56-,57-,58-,59+,60+,61-/m0/s1
SMILES C1[C@@H](C[C@H]2[C@](C1)([C@@H]1[C@@H](CC2)[C@@]2([C@]([C@@H](C1)OC(=O)C)([C@@](CC2)([C@@H](OC(=O)[C@H](CC)C)C)O)C)O)C)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]([C@H]1O)OC)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O)O)C)OC)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeTelosma procumbens Ref.
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