input word = C00017865

Metabolite InformationStructural formula
Name NSC 359079
Rebeccamycin
Formula C27H21Cl2N3O7
Mw 569.07565547
CAS RN 93908-02-2
C_ID C00017865 ,
InChIKey QEHOIJJIZXRMAN-OLIXIMDONA-N
InChICode InChI=1S/C27H21Cl2N3O7/c1-38-24-13(8-33)39-27(23(35)22(24)34)32-20-10(5-3-7-12(20)29)15-17-16(25(36)31-26(17)37)14-9-4-2-6-11(28)18(9)30-19(14)21(15)32/h2-7,13,22-24,27,30,33-35H,8H2,1H3,(H,31,36,37)/t13-,22-,23-,24-,27-/m1/s1
SMILES n1(c2c(c3c1c1c(c4c3c(=O)[nH]c4=O)c3c([nH]1)c(ccc3)Cl)cccc2Cl)[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)OC)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Tyr
Organism
Kingdom Family Species Reference
BacteriaNocardiaceaeNocardia aerocolonigens C-38383-RK-2 Ref.
--Lechevalieria aerocolonigenes C-38383 Ref.
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