input word = C00042294

Metabolite InformationStructural formula
Name Borealoside C
(+)-Borealoside C
Formula C33H58O9
Mw 598.40808345
CAS RN 143016-86-8
C_ID C00042294 ,
InChIKey PBCGIJBWPSEVKN-NMPURXRSNA-N
InChICode InChI=1S/C33H58O9/c1-17(2)25(42-30-27(38)28(40-6)24(37)16-41-30)8-7-18(3)20-14-22(35)29-32(20,5)12-10-26-31(4)11-9-19(34)13-21(31)23(36)15-33(26,29)39/h17-30,34-39H,7-16H2,1-6H3/t18-,19+,20-,21-,22+,23+,24-,25+,26-,27-,28-,29-,30-,31+,32-,33+/m1/s1
SMILES CO[C@@H]1[C@@H](O)[C@H](O[C@@H](CC[C@@H](C)[C@H]2C[C@H](O)[C@@H]3[C@]2(C)CC[C@@H]2[C@@]4(C)CC[C@H](O)C[C@@H]4[C@@H](O)C[C@]23O)C(C)C)OC[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaGoniasteridaeHippasteria phrygiana Ref.
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