input word = C00018030

Metabolite InformationStructural formula
Name Granaticin
Antibiotic WR 141
Granaticin A
Granatomycin C
Litmomycin
NSC 77038
WR 141
Formula C22H20O10
Mw 444.10564686
CAS RN 19879-06-2
C_ID C00018030 ,
InChIKey QBQXQYSJPWXZJL-UHFFFAOYNA-N
InChICode InChI=1S/C22H20O10/c1-5-11-15(21-8(30-5)4-10(24)32-21)19(27)13-14(17(11)25)20(28)16-12(18(13)26)7-3-9(23)22(16,29)6(2)31-7/h5-9,21,23,26,28-29H,3-4H2,1-2H3/t5-,6+,7-,8+,9-,21-,22-/m0/s1
SMILES c12c(C(=O)C3=C(C1=O)[C@@H]1[C@H](O[C@H]3C)CC(=O)O1)c(c1c(c2O)[C@@H]2C[C@@H]([C@]1([C@H](O2)C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces litmogenes Ref.
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OrganismStreptomyces litmogenes
ReferenceChang,J. Antibiotics,28,(1975),156