input word = C00045597

Metabolite InformationStructural formula
Name 9(13)-Cyclodiscodermolide
(+)-9(13)-Cyclodiscodermolide
Formula C33H53NO7
Mw 575.38220305
CAS RN 476172-88-0
C_ID C00045597 ,
InChIKey WKUKGIOEHKVKMX-SORPHYDYNA-N
InChICode InChI=1S/C33H53NO7/c1-10-11-13-17(2)31(41-33(34)39)23(8)28(35)19(4)16-18(3)27-22(7)29(36)20(5)25(27)14-12-15-26-21(6)30(37)24(9)32(38)40-26/h10-14,16-17,19-31,35-37H,1,15H2,2-9H3,(H2,34,39)/b13-11-,14-12+,18-16+/t17-,19-,20+,21+,22-,23+,24-,25+,26-,27-,28+,29+,30+,31-/m0/s1
SMILES C=C/C=CC(C)C(OC(N)=O)C(C)C(O)C(C)/C=C(C)C1C(C)C(O)C(C)C1/C=C/C[C@@H]1OC(=O)[C@H](C)[C@@H](O)[C@@H]1C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg L-Asp
Organism
Kingdom Family Species Reference
--Discodermia sp. Ref.
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