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Substance Name: Agrocin 84
RN: 59111-78-3
InChIKey: FIMRCGIHIAIVOL-DUQSPLRMSA-N

Note

  • Contains glucose, deoxy arabinose & other yet unidentified sugars.

Molecular Formula

  • C22-H36-N6-O16-P2

Molecular Weight

  • 702.5004
 
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Names and Synonyms

Name of Substance

  • Agrocin 84

Synonym

  • Agrocin

Systematic Name

  • Agrocin 84

Registry Numbers

CAS Registry Number

  • 59111-78-3

System Generated Number

  • 0059111783

Structure Descriptors

InChI

1S/C22H36N6O16P2/c1-8(2)13(32)15(34)20(36)27-45(37,38)41-5-9-3-10(30)21(42-9)28-7-25-12-18(23-6-24-19(12)28)26-46(39,40)44-22-16(35)14(33)17(43-22)11(31)4-29/h6-11,13-17,21-22,29-35H,3-5H2,1-2H3,(H2,27,36,37,38)(H2,23,24,26,39,40)/t9-,10-,11+,13+,14+,15-,16+,17-,21?,22?/m0/s1

InChIKey

FIMRCGIHIAIVOL-DUQSPLRMSA-N

Smiles

CC(C)[C@H]([C@@H](C(=O)NP(=O)(O)OC[C@@H]1C[C@@H](C(O1)[n@]2cnc3c2ncnc3NP(=O)(O)OC4[C@@H]([C@H]([C@@H](O4)[C@@H](CO)O)O)O)O)O)O