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Substance Name: Actinomycin D, 7-((2-naphthalenylcarbonyl)oxy)-
RN: 78542-33-3
InChIKey: CVXDJQSBJFVTGM-UHFFFAOYSA-N

Molecular Formula

  • C73-H92-N12-O18

Molecular Weight

  • 1425.6
 
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Names and Synonyms

Synonym

  • 7-((2-Naphthalenylcarbonyl)oxy)actinomycin D

Systematic Name

  • Actinomycin D, 7-((2-naphthalenylcarbonyl)oxy)-

Registry Numbers

CAS Registry Number

  • 78542-33-3

System Generated Number

  • 0078542333

Structure Descriptors

InChI

1S/C73H92N12O18/c1-33(2)52-69(95)84-27-19-23-45(84)67(93)80(13)31-48(86)82(15)58(35(5)6)72(98)100-39(11)54(65(91)76-52)78-63(89)44-30-47(102-71(97)43-26-25-41-21-17-18-22-42(41)29-43)37(9)61-56(44)75-57-50(51(74)60(88)38(10)62(57)103-61)64(90)79-55-40(12)101-73(99)59(36(7)8)83(16)49(87)32-81(14)68(94)46-24-20-28-85(46)70(96)53(34(3)4)77-66(55)92/h17-18,21-22,25-26,29-30,33-36,39-40,45-46,52-55,58-59H,19-20,23-24,27-28,31-32,74H2,1-16H3,(H,76,91)(H,77,92)(H,78,89)(H,79,90)

InChIKey

CVXDJQSBJFVTGM-UHFFFAOYSA-N

Smiles

c1(ccc2c(c1)cccc2)C(Oc1c(c2oc3c(c(C(N[C@@H]4[C@@H](OC([C@@H](N(C(CN(C(=O)[C@@H]5N(C([C@@H](NC4=O)C(C)C)=O)CCC5)C)=O)C)C(C)C)=O)C)=O)c(c(c3C)=O)N)nc2c(C(N[C@@H]2[C@@H](OC([C@@H](N(C(CN(C(=O)[C@@H]3N(C([C@@H](NC2=O)C(C)C)=O)CCC3)C)=O)C)C(C)C)=O)C)=O)c1)C)=O