input word = C00042258

Metabolite InformationStructural formula
Name Australin C
(+)-Australin C
Formula C26H42O7
Mw 466.2930537
CAS RN 863638-11-3
C_ID C00042258 ,
InChIKey CDBMAXFWXOUPQK-RBUJCQHDNA-N
InChICode InChI=1S/C26H42O7/c1-8-9-21(29)32-20-10-11-26(7,33-16(5)27)24-23-17(14(2)3)12-18(28)15(4)22(23)19(31-24)13-25(20,6)30/h14,17-20,22-24,28,30H,4,8-13H2,1-3,5-7H3/t17-,18+,19-,20+,22-,23-,24-,25+,26+/m1/s1
SMILES [C@@H]1(CC[C@@]([C@H]2[C@H]3[C@@H]([C@@H](C[C@]1(C)O)O2)C(=C)[C@H](C[C@@H]3C(C)C)O)(OC(=O)C)C)OC(=O)CCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Cladiella australis Ref.
zoom in