input word = C00017690

Metabolite InformationStructural formula
Name KS 501
Formula C33H48O10
Mw 604.32474775
CAS RN 120634-86-8
C_ID C00017690 ,
InChIKey MPAXORHHSMKMHV-WIXRBLDTNA-N
InChICode InChI=1S/C33H48O10/c1-3-5-7-9-11-13-21-15-23(35)18-25(16-21)41-32(40)28-22(14-12-10-8-6-4-2)17-24(36)19-27(28)42-33-30(39)29(38)31(43-33)26(37)20-34/h15-19,26,29-31,33-39H,3-14,20H2,1-2H3/t26-,29+,30-,31+,33-/m1/s1
SMILES c1(cc(cc(c1)CCCCCCC)OC(=O)c1c(cc(cc1CCCCCCC)O)O[C@@H]1O[C@H]([C@H]([C@H]1O)O)[C@@H](CO)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiOphiostomataceaeSporothrix sp. KAC-1985 Ref.
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