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enniatin C

enniatin C structure

enniatin C 

structure
  • CAS No:

    19893-23-3

  • Formula:

    C36H63N3O9

  • Chemical Name:

    enniatin C

  • Synonyms:

    antibiotic 86-88;enniatin A;enniatin B;enniatin C;enniatins;UNII-KI886GV7NT;ENNIATIN-C;KI886GV7NT;(3S,6R,9S,12R,15S,18R)-3,9,15-triisobutyl-6,12,18-triisopropyl-4,10,16-trimethyl-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexaone

enniatin C Basic Attributes

681.90012

681.456

KI886GV7NT

Characteristics

140

7.6

1.012±0.06 g/cm3(Predicted)

159-160 °C

848.0±65.0 °C(Predicted)

Safety Information

I

6.1(a)

2811

Drug Information

antibiotic 86-88

Computed Properties

Molecular Weight:681.9
XLogP3:7.6
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:9
Exact Mass:681.45643060
Monoisotopic Mass:681.45643060
Topological Polar Surface Area:140
Heavy Atom Count:48
Complexity:996
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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