input word = C00044143

Metabolite InformationStructural formula
Name Deacetyllittoraloin
(-)-Deacetyllittoraloin
Formula C26H30O22
Mw 694.12287265
CAS RN 179983-85-8
C_ID C00044143 ,
InChIKey LHIPKJMQYMTREZ-ZMVCLJPNNA-N
InChICode InChI=1S/C26H30O12/c1-10(11(2)28)25(35)37-9-12-6-14-19(16(30)7-12)21(32)18-13(4-3-5-15(18)29)26(14,36)24-23(34)22(33)20(31)17(8-27)38-24/h3-7,10-11,17,20,22-24,27-31,33-34,36H,8-9H2,1-2H3/t10-,11+,17-,20-,22+,23-,24-,26+/m1/s1
SMILES C[C@H](O)[C@@H](C)C(=O)OCc1cc(O)c2c(c1)[C@](O)([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1cccc(O)c1C2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsphodelaceaeAloe littoralis Ref.
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