input word = C00048845

Metabolite InformationStructural formula
Name Robustolide K
Formula C26H33ClO10
Mw 540.17622499
CAS RN 1124328-13-7
C_ID C00048845 ,
InChIKey ZRZXIRDSOAIGOX-CIHGWTOFNA-N
InChICode InChI=1S/C26H33ClO10/c1-12-7-8-17(33-14(3)29)24(6)18(34-15(4)30)9-10-25(11-28)20(27)22-26(37-25,13(2)23(32)36-22)21(19(12)24)35-16(5)31/h9-10,13,17-22,28H,1,7-8,11H2,2-6H3/b10-9+/t13-,17-,18-,19+,20+,21-,22-,24+,25+,26+/m0/s1
SMILES C=C1CC[C@H](OC(C)=O)[C@]2(C)[C@@H](OC(C)=O)/C=C/[C@]3(CO)O[C@@]4(C(OC(=O)[C@@H]4C)[C@H]3Cl)[C@@H](OC(C)=O)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Ellisella robusta Ref.
zoom in