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Substance Name: Naltrexone-estrone azine
RN: 140188-23-4
InChIKey: KWRMQORSCWANRR-XMSFGIAZSA-N

Molecular Formula

  • C38-H45-N3-O4

Molecular Weight

  • 607.7905
 
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Names and Synonyms

Name of Substance

  • Naltrexone-estrone azine

Synonym

  • EH-NX

Systematic Name

  • Morphinan-6-one, 17-(cyclopropylmethyl)-4,5-epoxy-3,14-dihydroxy-, ((3beta)-3-hydroxyestra-1,3,5(10)-trien-17-ylidene)hydrazide, (5alpha)-

Registry Numbers

CAS Registry Number

  • 140188-23-4

System Generated Number

  • 0140188234

Structure Descriptors

InChI

1S/C38H45N3O4/c1-36-14-12-26-25-8-6-24(42)18-22(25)4-7-27(26)28(36)9-11-31(36)40-39-29-13-15-38(44)32-19-23-5-10-30(43)34-33(23)37(38,35(29)45-34)16-17-41(32)20-21-2-3-21/h5-6,8,10,18,21,26-28,32,35,42-44H,2-4,7,9,11-17,19-20H2,1H3/b39-29-,40-31+

InChIKey

KWRMQORSCWANRR-XMSFGIAZSA-N

Smiles

CC1\2CCC3c4ccc(cc4CCC3C1CC/C2=N\N=C/5\CCC6(C7Cc8ccc(c9c8C6(C5O9)CCN7CC1CC1)O)O)O