input word = C00048746

Metabolite InformationStructural formula
Name Kurilensoside D
(-)-Kurilensoside D
Formula C38H66O14
Mw 746.44525682
CAS RN 1020852-83-8
C_ID C00048746 ,
InChIKey TYASOKZTTOQZLV-KLNWDXEFNA-N
InChICode InChI=1S/C38H66O14/c1-17(2)24(51-34-31(46)30(45)25(52-34)16-50-35-32(48-6)29(44)23(42)15-49-35)8-7-18(3)19-13-21(40)33-36(19,4)12-10-26-37(5)11-9-20(39)28(43)27(37)22(41)14-38(26,33)47/h17-35,39-47H,7-16H2,1-6H3/t18-,19-,20+,21-,22+,23+,24+,25-,26-,27+,28+,29+,30+,31+,32+,33-,34+,35+,36-,37-,38+/m1/s1
SMILES C1[C@H]2[C@]([C@H]3[C@](C1)([C@H](C[C@H]3O)[C@H](C)CC[C@H](O[C@H]1O[C@@H]([C@@H]([C@@H]1O)O)CO[C@@H]1OC[C@@H]([C@@H]([C@@H]1OC)O)O)C(C)C)C)(C[C@@H]([C@@H]1[C@@]2(CC[C@@H]([C@@H]1O)O)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaGoniasteridaeHippasteria kurilensis Ref.
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