input word = C00018372

Metabolite InformationStructural formula
Name Isariin D
Formula C26H45N5O7
Mw 539.33189883
CAS RN 80111-97-3
C_ID C00018372 ,
InChIKey OMCRYJIAXGEETJ-UHFFFAOYNA-N
InChICode InChI=1S/C26H45N5O7/c1-8-9-10-18-12-20(32)27-13-21(33)31-22(15(4)5)25(36)30-19(11-14(2)3)24(35)28-16(6)23(34)29-17(7)26(37)38-18/h14-19,22H,8-13H2,1-7H3,(H,27,32)(H,28,35)(H,29,34)(H,30,36)(H,31,33)/t16-,17+,18+,19+,22+/m1/s1
SMILES C1(=O)O[C@H](CC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H]1C)C)CC(C)C)C(C)C)CCCC
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
--Isaria felina Ref.
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