input word = C00030872

Metabolite InformationStructural formula
Name Oblonganoside E
(+)-Oblonganoside E
Formula C36H56O10
Mw 648.38734801
CAS RN 943021-92-9
C_ID C00030872 ,
InChIKey OEFKFUDBPRUSIA-WNWPVWIENA-N
InChICode InChI=1S/C36H56O10/c1-19-9-14-36(30(43)46-29-27(42)26(41)25(40)21(17-37)45-29)16-15-33(4)20(28(36)35(19,6)44)7-8-23-31(2)12-11-24(39)32(3,18-38)22(31)10-13-34(23,33)5/h7,21-29,37-42,44H,1,8-18H2,2-6H3/t21-,22-,23-,24+,25+,26+,27-,28-,29+,31+,32-,33-,34-,35-,36+/m1/s1
SMILES C1[C@@H]([C@@]([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@](CC2)(CCC(=C)[C@@]1(C)O)C(=O)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)C)C)C)(CO)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAquifoliaceaeIlex oblonga Ref.
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