input word = C00048749

Metabolite InformationStructural formula
Name Laurenmariannol
Formula C30H53BrO7
Mw 604.29746695
CAS RN 1049712-54-0
C_ID C00048749 ,
InChIKey LDQVWFLDLPYOLQ-GGAIUSQRNA-N
InChICode InChI=1S/C30H53BrO7/c1-25(2,33)20(32)12-15-27(5,34)21-13-17-29(7,36-21)24-10-9-22-28(6,37-24)18-14-23(35-22)30(8)16-11-19(31)26(3,4)38-30/h19-24,32-34H,9-18H2,1-8H3/t19-,20-,21+,22-,23-,24-,27-,28+,29-,30+/m1/s1
SMILES CC(C)(O)C(O)CCC(C)(O)[C@@H]1CC[C@](C)([C@H]2CC[C@H]3O[C@@H]([C@]4(C)CC[C@@H](Br)C(C)(C)O4)CC[C@]3(C)O2)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Laurencia mariannensis Ref.
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