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Substance Name: Actinomycin D, 7-((2-furanylmethyl)amino)-
RN: 67230-64-2
InChIKey: GQJNROWSLOLKBI-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C67-H91-N13-O17

Molecular Weight

  • 1350.53
 
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Names and Synonyms

Synonym

  • 7-((2-Furanylmethyl)amino)actinomycin D

Systematic Name

  • Actinomycin D, 7-((2-furanylmethyl)amino)-

Registry Numbers

CAS Registry Number

  • 67230-64-2

System Generated Number

  • 0067230642

Structure Descriptors

InChI

1S/C67H91N13O17/c1-30(2)47-64(90)79-23-17-21-41(79)62(88)75(13)28-43(81)77(15)53(32(5)6)66(92)95-36(11)49(60(86)71-47)73-58(84)39-26-40(69-27-38-20-19-25-94-38)34(9)56-51(39)70-52-45(46(68)55(83)35(10)57(52)97-56)59(85)74-50-37(12)96-67(93)54(33(7)8)78(16)44(82)29-76(14)63(89)42-22-18-24-80(42)65(91)48(31(3)4)72-61(50)87/h19-20,25-26,30-33,36-37,41-42,47-50,53-54,69H,17-18,21-24,27-29,68H2,1-16H3,(H,71,86)(H,72,87)(H,73,84)(H,74,85)

InChIKey

GQJNROWSLOLKBI-UHFFFAOYSA-N

Smiles

o1c(ccc1)CNc1c(c2c(nc3c(o2)c(c(c(c3C(N[C@@H]2C(N[C@@H](C(N3[C@@H](C(N(CC(N([C@@H](C(O[C@@H]2C)=O)C(C)C)C)=O)C)=O)CCC3)=O)C(C)C)=O)=O)N)=O)C)c(C(N[C@@H]2C(N[C@@H](C(N3[C@@H](C(N(CC(N([C@@H](C(C)C)C(=O)O[C@@H]2C)C)=O)C)=O)CCC3)=O)C(C)C)=O)=O)c1)C