input word = C00015016

Metabolite InformationStructural formula
Name Himalomycin B
Formula C43H56O16
Mw 828.35683574
CAS RN 701915-11-9
C_ID C00015016 ,
InChIKey KKNQZECZFJSPQR-AWNQKUEGNA-N
InChICode InChI=1S/C43H56O16/c1-19-27(44)10-13-33(54-19)57-30-12-15-35(56-21(30)3)59-43(5,18-32(47)48)17-23-6-7-25-36(38(23)49)40(51)26-9-8-24(39(50)37(26)41(25)52)31-16-29(46)42(22(4)53-31)58-34-14-11-28(45)20(2)55-34/h6-9,19-22,27-31,33-35,42,44-46,49-50H,10-18H2,1-5H3,(H,47,48)/t19-,20-,21-,22+,27+,28+,29+,30-,31+,33-,34-,35-,42-,43+/m0/s1
SMILES C1[C@H]([C@@H](O[C@H](C1)O[C@H]1CC[C@@H](O[C@H]1C)O[C@@](CC(=O)O)(Cc1ccc2c(c1O)C(=O)c1c(C2=O)c(c(cc1)[C@H]1C[C@H]([C@H]([C@H](O1)C)O[C@@H]1O[C@H]([C@@H](CC1)O)C)O)O)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. B6921 Ref.
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