input word = C00056716

Metabolite InformationStructural formula
Name Litchioside A
Formula C31H52O10
Mw 584.35604788
CAS RN 1246016-59-0
C_ID C00056716
InChIKey SITHCODNGJUDFC-WAHYDANFSA-N
InChICode InChI=1S/C31H52O10/c1-17(2)20-10-13-30(5)22(33)11-14-31(6,38)27(30)26(20)41-29-25(36)24(35)23(34)21(40-29)16-39-28(37)19(4)9-7-8-18(3)12-15-32/h8-9,17,20-27,29,32-36,38H,7,10-16H2,1-6H3/b18-8+,19-9+/t20-,21+,22-,23+,24-,25+,26+,27-,29-,30+,31-/m0/s1
SMILES C/C(=CC/C=C(C)C(=O)OC[C@H]1O[C@@H](O[C@@H]2[C@H](C(C)C)CC[C@]3(C)[C@@H](O)CC[C@](C)(O)[C@@H]23)[C@H](O)[C@@H](O)[C@@H]1O)CCO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSapindaceaeLitchi chinensis Ref.
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