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Substance Name: Dibromophakellstatine
RN: 185750-71-4
InChIKey: QRIRJBWPCUYVPR-FTNKSUMCSA-N

Notes

  • From the Indian Ocean sponge, Phakellia mauritiana.
  • Isolated from the Indian ocean sponge Phakellia mauritiana

Classification Code

  • Antineoplastic

Molecular Formula

  • C11-H10-Br2-N4-O2

Molecular Weight

  • 390.034
 
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Names and Synonyms

Results Name

  • Dibromophakellstatine

Synonym

  • Dibromophakellstatin

Systematic Names

  • 4H,8H-Imidazo(4,5-b)dipyrrolo(1,2-a:1',2'-d)pyrazine-2,8(3H)-dione, 10,11-dibromo-1,5,6,12a-tetrahydro-, (3aR,12aS)-
  • 4H,8H-Imidazo(4,5-b)dipyrrolo(1,2-a:1',2'-d)pyrazine-2,8(3H)-dione, 10,11-dibromo-1,5,6,12a-tetrahydro-, (3aR-(3aR*,12aS*))-

Registry Numbers

CAS Registry Number

  • 185750-71-4

System Generated Number

  • 0185750714

Structure Descriptors

InChI

1S/C11H10Br2N4O2/c12-5-4-6-8(18)16-3-1-2-11(16)9(14-10(19)15-11)17(6)7(5)13/h4,9H,1-3H2,(H2,14,15,19)/t9-,11?/m0/s1

InChIKey

QRIRJBWPCUYVPR-FTNKSUMCSA-N

Smiles

c1c(c(n2c1C(=O)N3CCCC34[C@H]2NC(=O)N4)Br)Br