input word = C00050385

Metabolite InformationStructural formula
Name Manauealide C
Formula C34H50O11
Mw 634.33531244
CAS RN 195734-70-4
C_ID C00050385 ,
InChIKey TYIVYKUKAGDZDP-UHFFFAOYNA-N
InChICode InChI=1S/C34H50O11/c1-19(12-13-26(40-8)24-10-9-11-25(36)14-24)31-21(3)28-17-34(44-31)32(6,7)16-20(2)33(39,45-34)18-30(38)42-27(15-29(37)43-28)22(4)41-23(5)35/h9-11,14,19-22,26-28,31,36,39H,12-13,15-18H2,1-8H3/t19-,20-,21+,22+,26+,27-,28-,31-,33+,34-/m1/s1
SMILES O1[C@@]23C[C@H]([C@@H]([C@H]1[C@@H](CC[C@H](OC)c1cc(ccc1)O)C)C)OC(=O)C[C@@H](OC(=O)C[C@@]([C@@H](CC2(C)C)C)(O3)O)[C@@H](OC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--GracilariaceaeGracilaria coronopifolia Ref.
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OrganismGracilaria coronopifolia
ReferenceNagai,J.Nat.Prod.,60,(1997),925