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Substance Name: Agropine
RN: 70699-77-3
InChIKey: HCWLJSDMOMMDRF-SZWOQXJISA-N

Molecular Weight

  • 292.286
 
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Names and Synonyms

Name of Substance

  • Agropine

Synonyms

  • (1'-Deoxy-D-mannitol-1'-yl)-L-glutamine,1',2'-lactone
  • 1H-Pyrrolo(2,1-c)(1,4)oxazine-1,6(7H)-dione, tetrahydro-3-(1,2,3,4-tetrahydroxybutyl)-

Systematic Name

  • D-Mannitol, 1-((4-amino-1-carboxy-4-oxobutyl)amino)-1-deoxy-, intermol. 1,2-ester, (S)-

Registry Numbers

CAS Registry Number

  • 70699-77-3

System Generated Number

  • 0070699773

Structure Descriptors

InChI

1S/C11H20N2O7/c12-8(16)2-1-5-11(19)20-7(3-13-5)10(18)9(17)6(15)4-14/h5-7,9-10,13-15,17-18H,1-4H2,(H2,12,16)/t5-,6+,7+,9+,10+/m0/s1

InChIKey

HCWLJSDMOMMDRF-SZWOQXJISA-N

Smiles

C1([C@@H](NC[C@@H](O1)[C@H]([C@@H]([C@@H](CO)O)O)O)CCC(=O)N)=O