input word = C00018018

Metabolite InformationStructural formula
Name NSC 204855
Steffimycin B
Formula C29H32O13
Mw 588.18429111
CAS RN 54526-94-2
C_ID C00018018 ,
InChIKey VHJWDTPKSIFZBV-AWRWYCRZNA-N
InChICode InChI=1S/C29H32O13/c1-10-23(38-4)22(34)25(39-5)28(41-10)42-24-18-14(26(35)29(2,36)27(24)40-6)9-13-17(21(18)33)20(32)16-12(19(13)31)7-11(37-3)8-15(16)30/h7-10,22-25,27-28,30,33-34,36H,1-6H3/t10-,22+,23-,24-,25-,27+,28-,29+/m0/s1
SMILES COc1cc(O)c2c(c1)C(=O)c1cc3c(c(O)c1C2=O)C(O[C@@H]1OC(C)[C@H](OC)[C@@H](O)C1OC)C(OC)C(C)(O)C3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces elgrereus Ref.
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