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Substance Name: 11-Progesteryl-2-succinoyltyramine-4-(10-methyl)acridinium-9-carboxylate
RN: 99195-33-2
InChIKey: PRJJJIHENBJWKZ-NEMBYOKESA-N

Molecular Formula

  • C47-H50-N2-O7

Molecular Weight

  • 754.919
 
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Names and Synonyms

Name of Substance

  • 11-Progesteryl-2-succinoyltyramine-4-(10-methyl)acridinium-9-carboxylate

Synonym

  • 11-Pstmac

Systematic Name

  • Pregn-4-ene-3,20-dione, 11-(4-((2-(4-((9-acridinylcarbonyl)oxy)phenyl)ethyl)amino)-1,4-dioxobutoxy)-, (11alpha)-

Registry Numbers

CAS Registry Number

  • 99195-33-2

System Generated Number

  • 0099195332

Structure Descriptors

InChI

1S/C47H50N2O7/c1-28(50)36-18-19-37-33-17-14-30-26-31(51)22-24-46(30,2)44(33)40(27-47(36,37)3)56-42(53)21-20-41(52)48-25-23-29-12-15-32(16-13-29)55-45(54)43-34-8-4-6-10-38(34)49-39-11-7-5-9-35(39)43/h4-13,15-16,26,33,36-37,40,44H,14,17-25,27H2,1-3H3,(H,48,52)/t33-,36+,37-,40+,44+,46-,47+/m0/s1

InChIKey

PRJJJIHENBJWKZ-NEMBYOKESA-N

Smiles

n1c2ccccc2c(c2ccccc12)C(=O)Oc1ccc(cc1)CCNC(CCC(O[C@H]1[C@H]2[C@H]([C@H]3[C@@](C1)([C@H](CC3)C(C)=O)C)CCC=1[C@@]2(CCC(C1)=O)C)=O)=O