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Substance Name: Raocyclamide A
RN: 174846-65-2
InChIKey: PNCLWRPJCHTJRB-XJSPYZKOSA-N

Molecular Formula

  • C27-H30-N6-O5-S

Molecular Weight

  • 550.637
 
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Names and Synonyms

Results Name

  • Raocyclamide A

Synonym

  • Raocyclamide A

Systematic Names

  • 6,13-Dioxa-20-thia-3,10,17,22,23,24-hexaazatetracyclo(172115,8112,15)tetracosa-5(24),12(23),14,19(22),21-pentaene-2,9,16-trione, 11-methyl-18-((1S)-1-methylpropyl)-4-(phenylmethyl)-, (4R,8R,11S,18S)-
  • 6,13-Dioxa-20-thia-3,10,17,22,23,24-hexaazatetracyclo(172115,8112,15)tetracosa-5(24),12(23),14,19(22),21-pentaene-2,9,16-trione, 11-methyl-18-(1-methylpropyl)-4-(phenylmethyl)-, (4R-(4R*,8R*,11S*,18S*(S*)))-

Registry Numbers

CAS Registry Number

  • 174846-65-2

System Generated Number

  • 0174846652

Structure Descriptors

InChI

1S/C27H30N6O5S/c1-4-14(2)21-27-32-20(13-39-27)24(36)29-17(10-16-8-6-5-7-9-16)26-31-18(12-38-26)22(34)28-15(3)25-30-19(11-37-25)23(35)33-21/h5-9,11,13-15,17-18,21H,4,10,12H2,1-3H3,(H,28,34)(H,29,36)(H,33,35)/t14-,15-,17+,18+,21-/m0/s1

InChIKey

PNCLWRPJCHTJRB-XJSPYZKOSA-N

Smiles

c1oc2nc1C(N[C@H](c1scc(C(N[C@@H](C=3OC[C@@H](C(N[C@H]2C)=O)N3)Cc2ccccc2)=O)n1)[C@H](CC)C)=O