input word = C00048715

Metabolite InformationStructural formula
Name Fuscaside A
(+)-Fuscaside A
Formula C37H64O16S
Mw 796.39150673
CAS RN 1136150-18-9
C_ID C00048715 ,
InChIKey BQMZNIWFFKRTDK-AQCOABTBNA-N
InChICode InChI=1S/C37H64O16S/c1-17(2)25(52-34-31(44)29(42)24(40)16-50-34)7-6-18(3)20-13-26(53-54(46,47)48)32-36(20,5)11-9-27-35(4)10-8-19(12-21(35)22(38)14-37(27,32)45)51-33-30(43)28(41)23(39)15-49-33/h17-34,38-45H,6-16H2,1-5H3,(H,46,47,48)/t18-,19+,20-,21-,22-,23-,24+,25+,26+,27-,28+,29+,30-,31+,32-,33+,34+,35+,36-,37+/m1/s1
SMILES C1[C@H]2[C@]([C@H]3[C@](C1)([C@H](C[C@@H]3OS(=O)(=O)O)[C@@H](CC[C@H](O[C@H]1[C@H]([C@H]([C@H](CO1)O)O)O)C(C)C)C)C)(C[C@H]([C@@H]1[C@@]2(CC[C@@H](C1)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaAsteriidaeLethasterias fusca Ref.
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