input word = C00018002

Metabolite InformationStructural formula
Name 18-Dihydro-9-propionylmaridomycin III
Formula C44H73NO17
Mw 887.48784992
CAS RN 53839-24-0
C_ID C00018002 ,
InChIKey KBFCQYXELISVHG-FOCLMDBBNA-N
InChICode InChI=1S/C44H73NO17/c1-12-32(47)58-28-15-16-29-30(57-29)20-24(5)54-35(50)21-31(59-33(48)13-2)41(53-11)40(27(17-18-46)19-23(28)4)62-43-38(51)37(45(9)10)39(25(6)56-43)61-36-22-44(8,52)42(26(7)55-36)60-34(49)14-3/h15-16,23-31,36-43,46,51-52H,12-14,17-22H2,1-11H3/b16-15+/t23-,24-,25-,26-,27-,28-,29-,30-,31-,36+,37+,38+,39-,40+,41+,42-,43-,44-/m0/s1
SMILES CCC(=O)OC1/C=C/C2OC2CC(C)OC(=O)CC(OC(=O)CC)C(OC)C(OC2OC(C)C(OC3CC(C)(O)C(OC(=O)CC)C(C)O3)C(N(C)C)C2O)C(CCO)CC1C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Secologanin
Organism
Kingdom Family Species Reference
BacteriaNocardiaceaeNocardia mexicana IFO 3927 Ref.
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