input word = C00016658

Metabolite InformationStructural formula
Name (+)-Crocacin A
Crocacin
Crocacin A
Formula C31H42N2O6
Mw 538.30428709
CAS RN 157698-34-5
C_ID C00016658 ,
InChIKey XHTUDGVBJDVOEZ-ZZFHLCHKNA-N
InChICode InChI=1S/C31H42N2O6/c1-23(21-29(35)32-20-12-8-11-15-28(34)33-22-30(36)38-5)16-17-24(2)31(39-6)25(3)27(37-4)19-18-26-13-9-7-10-14-26/h7,9-21,24-25,27,31H,8,22H2,1-6H3,(H,32,35)(H,33,34)/b15-11-,17-16+,19-18+,20-12-,23-21+/t24-,25+,27-,31-/m0/s1
SMILES COC(=O)CNC(=O)/C=CC/C=CNC(=O)/C=C(C)/C=C/[C@H](C)[C@H](OC)[C@H](C)[C@H](/C=C/c1ccccc1)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-Phe
Organism
Kingdom Family Species Reference
BacteriaPolyangiaceaeChondromyces crocatus Cm c3 Ref.
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OrganismChondromyces crocatus Cm c3
ReferenceKunze,J.Antibiotics 47,(1994),881