input word = C00015722

Metabolite InformationStructural formula
Name Pacidamycin d
Formula C32H41N9O10
Mw 711.2976386
CAS RN 287107-95-3
C_ID C00015722 ,
InChIKey PBFVZISIBPPZNE-KZNJRMHSNA-N
InChICode InChI=1S/C32H41N9O10/c1-15(33)28(46)40(4)17(3)25(27(45)35-14-19-12-23(42)29(51-19)41-10-9-24(43)38-32(41)50)39-26(44)16(2)36-31(49)37-22(30(47)48)11-18-13-34-21-8-6-5-7-20(18)21/h5-10,13-17,22-23,25,29,34,42H,11-12,33H2,1-4H3,(H,35,45)(H,39,44)(H,47,48)(H2,36,37,49)(H,38,43,50)/b19-14-/t15-,16-,17+,22-,23+,25-,29+/m0/s1
SMILES c1(C[C@H](NC(=O)N[C@H](C(=O)N[C@H](C(=O)N/C=C/2\O[C@H]([C@@H](C2)O)n2ccc(=O)[nH]c2=O)[C@@H](C)N(C(=O)[C@H](C)N)C)C)C(=O)O)c[nH]c2c1cccc2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces coeruleorubidus NRRL 18370 Ref.
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