input word = C00016425

Metabolite InformationStructural formula
Name FD 895
Formula C31H50O9
Mw 566.3454832
CAS RN 147025-57-8
C_ID C00016425 ,
InChIKey LDCZLUDGHYDTHV-XEHSWGDBNA-N
InChICode InChI=1S/C31H50O9/c1-9-24(37-8)21(5)29-30(40-29)27(35)18(2)11-10-12-19(3)28-20(4)13-14-25(38-22(6)32)31(7,36)16-15-23(33)17-26(34)39-28/h10-14,18,20-21,23-25,27-30,33,35-36H,9,15-17H2,1-8H3/b11-10+,14-13+,19-12-/t18-,20+,21+,23+,24+,25-,27-,28-,29+,30+,31+/m0/s1
SMILES C1C[C@]([C@H](/C=C/[C@H]([C@@H](OC(=O)C[C@@H]1O)/C(=C\C=C\[C@H](C)[C@H](O)[C@@H]1[C@H](O1)[C@H](C)[C@@H](CC)OC)/C)C)OC(=O)C)(O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces hygroscopicus A-9561 Ref.
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OrganismStreptomyces hygroscopicus A-9561
ReferenceSeki-Asano,J.Antibiotics 47,(1994),1395