input word = C00016304

Metabolite InformationStructural formula
Name Saccharocarcin D
Formula C67H101NO19
Mw 1223.69678005
CAS RN 158475-35-5
C_ID C00016304 ,
InChIKey KWTVHMCLDKKCAT-UGFURXGPNA-N
InChICode InChI=1S/C67H101NO19/c1-15-42-16-17-43-26-35(6)58(86-54-30-65(13,76)61(40(11)81-54)68-41(12)69)33(4)24-31(2)45-19-18-44-56(66(45,14)62(73)55-63(74)67(43,29-42)87-64(55)75)32(3)25-34(5)59(44)84-51-23-21-48(37(8)78-51)82-53-28-49(83-50-22-20-46(70)36(7)77-50)60(39(10)80-53)85-52-27-47(71)57(72)38(9)79-52/h16-19,24,26,32-34,36-40,42-54,56-61,70-72,74,76H,15,20-23,25,27-30H2,1-14H3,(H,68,69)/b31-24-,35-26+/t32-,33-,34-,36-,37-,38-,39+,40-,42-,43+,44-,45+,46+,47-,48-,49+,50-,51-,52-,53+,54-,56+,57+,58-,59-,60-,61+,65+,66+,67+/m0/s1
SMILES CCC1C=CC2/C=C(C)C(OC3CC(C)(O)C(NC(C)=O)C(C)O3)C(C)/C=C(/C)C3C=CC4C(OC5CCC(OC6CC(OC7CCC(O)C(C)O7)C(OC7CC(O)C(O)C(C)O7)C(C)O6)C(C)O5)C(C)CC(C)C4C3(C)C(=O)C3=C(O)C2(C1)OC3=O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
--Lechevalieria aerocolonigenes subsp. antibiotica Ref.
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