input word = C00015042

Metabolite InformationStructural formula
Name GTRI-BB
Formula C33H26O13
Mw 630.13734092
CAS RN 484012-88-6
C_ID C00015042 ,
InChIKey HODQAOCEAGGJKA-ARZUEKDKNA-N
InChICode InChI=1S/C33H26O13/c1-10-22-26(30(40)18(44-10)8-20(36)43-3)31(41)24-14(28(22)38)4-12(6-16(24)34)13-5-15-25(17(35)7-13)32(42)27-23(29(15)39)11(2)45-19-9-21(37)46-33(19)27/h4-7,10-11,18-19,30,33-35,40H,8-9H2,1-3H3/t10-,11-,18-,19-,30+,33+/m0/s1
SMILES O1[C@H]([C@H](C2=C([C@@H]1C)C(=O)c1c(C2=O)c(cc(c1)c1cc2c(c(c1)O)C(=O)C1=C(C2=O)[C@@H](O[C@@H]2[C@H]1OC(=O)C2)C)O)O)CC(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaMicromonosporaceaeMicromonospora sp. SA-246 Ref.
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