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Substance Name: Saframycin G
RN: 92569-02-3
InChIKey: YQQUMADRNAOVHP-SEBJRLBMSA-N

Molecular Formula

  • C29-H30-N4-O9

Molecular Weight

  • 578.575
 
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Names and Synonyms

Name of Substance

  • Saframycin G

Synonym

  • 14-Hydroxysaframycin A

Systematic Name

  • Propanamide, N-((7-cyano-1,5,6,7,9,10,13,14,14a,15-decahydro-5-hydroxy-2,11-dimethoxy-3,12,16-trimethyl-1-4-10,13-tetraoxo-6,15-imino-4H-isoquino(3,2-b)(3)benzazocin-9-yl)methyl)-2-oxo-, (5S-(5alpha,6alpha,7alpha,9beta,14aalpha,15alpha))-

Registry Numbers

CAS Registry Number

  • 92569-02-3

System Generated Number

  • 0092569023

Structure Descriptors

InChI

1S/C29H30N4O9/c1-10-22(35)13-7-14-20-18-19(23(36)11(2)28(42-6)26(18)39)24(37)21(32(20)4)15(8-30)33(14)16(9-31-29(40)12(3)34)17(13)25(38)27(10)41-5/h14-16,20-21,24,37H,7,9H2,1-6H3,(H,31,40)/t14-,15?,16-,20-,21+,24-/m0/s1

InChIKey

YQQUMADRNAOVHP-SEBJRLBMSA-N

Smiles

CC1=C(C(=O)C2=C(C1=O)C[C@H]3[C@H]4C5=C([C@@H]([C@H](N4C)C(N3[C@H]2CNC(=O)C(=O)C)C#N)O)C(=O)C(=C(C5=O)OC)C)OC