input word = C00030264

Metabolite InformationStructural formula
Name Floralquinquenoside A
(+)-Floralquinquenoside A
Formula C36H62O11
Mw 670.42921282
CAS RN 958641-31-1
C_ID C00030264 ,
InChIKey VCIATBKNMKVKOS-SBEPQSIWNA-N
InChICode InChI=1S/C36H62O11/c1-31(2,47-44)12-9-13-36(8,43)19-10-15-34(6)25(19)20(38)16-23-33(5)14-11-24(39)32(3,4)29(33)21(17-35(23,34)7)45-30-28(42)27(41)26(40)22(18-37)46-30/h9,12,19-30,37-44H,10-11,13-18H2,1-8H3/b12-9+/t19-,20+,21-,22+,23+,24-,25-,26-,27-,28+,29-,30+,33+,34+,35+,36-/m0/s1
SMILES C1[C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@](C[C@@H]2O[C@@H]2O[C@@H]([C@@H]([C@@H]([C@H]2O)O)O)CO)([C@]2([C@H]([C@@H](C1)O)[C@H](CC2)[C@@](C/C=C/C(C)(C)OO)(C)O)C)C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax quinquefolium L. Ref.
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