input word = C00018375

Metabolite InformationStructural formula
Name Antibiotic OS 4742A1
P 1894B
Vineomycin A1
Formula C49H58O18
Mw 934.36231505
CAS RN 78164-00-8
C_ID C00018375 ,
InChIKey YHSTYYHRDFATAQ-XPAHEAQJNA-N
InChICode InChI=1S/C49H58O18/c1-22-30(50)9-13-37(60-22)64-33-11-15-39(62-24(33)3)66-46-26(5)59-35(19-32(46)52)27-7-8-28-41(43(27)54)44(55)29-17-18-48(57)21-47(6,20-36(53)49(48,58)42(29)45(28)56)67-40-16-12-34(25(4)63-40)65-38-14-10-31(51)23(2)61-38/h7-10,13-14,17-18,22-26,32-35,37-40,46,52,54,57-58H,11-12,15-16,19-21H2,1-6H3/t22-,23-,24-,25-,26+,32+,33-,34-,35+,37-,38-,39-,40-,46+,47-,48-,49-/m0/s1
SMILES C1=C[C@@H](O[C@H](C1=O)C)O[C@H]1CC[C@@H](O[C@H]1C)O[C@@H]1[C@H](O[C@H](C[C@H]1O)c1c(c2c(cc1)C(=O)C1=C(C2=O)C=C[C@]2([C@@]1(C(=O)C[C@@](C2)(O[C@@H]1O[C@H]([C@H](CC1)O[C@H]1C=CC(=O)[C@@H](O1)C)C)C)O)O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. No.1894 Ref.
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