input word = C00044261

Metabolite InformationStructural formula
Name Nahocol B
Formula C29H42O5
Mw 470.30322445
CAS RN 160262-43-1
C_ID C00044261 ,
InChIKey YMFSSKIJSZRDHG-UUYOSTAYNA-N
InChICode InChI=1S/C29H42O5/c1-8-29(6,34-27-17-15-25(30)19-24(27)20-28(32)33-7)18-10-12-22(4)11-9-13-23(5)26(31)16-14-21(2)3/h8,12,14-15,17,19,23,30H,1,9-11,13,16,18,20H2,2-7H3/b22-12-/t23-,29+/m1/s1
SMILES c1cc(cc(c1O[C@](CC/C=C(\CCC[C@H](C(=O)CC=C(C)C)C)/C)(C=C)C)CC(=O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ChromalveolataSargassaceaeSargassum autumnale Ref.
zoom in