input word = C00017616

Metabolite InformationStructural formula
Name Paulomenol A
Formula C29H43NO16
Mw 661.25818434
CAS RN 94739-81-8
C_ID C00017616 ,
InChIKey RVRAOUPNLRDSKL-UHFFFAOYNA-N
InChICode InChI=1S/C29H43NO16/c1-7-11(2)27(38)44-13(4)29(40)12(3)43-18(8-17(29)41-6)46-23-21(33)16(10-42-14(5)31)45-25(22(23)34)28(39)9-15(32)20(30)19(24(28)35)26(36)37/h11-13,16-18,21-23,25,33-34,39-40H,7-10,30H2,1-6H3,(H,36,37)/t11-,12+,13+,16+,17+,18+,21+,22+,23+,25+,28-,29+/m1/s1
SMILES CCC(C)C(=O)OC(C)C1(O)C(C)OC(OC2C(O)C(COC(C)=O)OC(C3(O)CC(=O)C(N)=C(C(=O)O)C3=O)C2O)CC1OC
Start Substs in Alk. Biosynthesis (Prediction) L-Arg
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces paulus strain No.273 Ref.
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