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Substance Name: Psammaplysin C
RN: 142449-78-3
InChIKey: KHWOJHLZIWAPIG-UHFFFAOYSA-N

Note

  • From marine sponge Druinella purpurea; has in vitro cytotoxicity towards human colon tumor cell-line HCT116.

Molecular Weight

  • 763.07
 
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Names and Synonyms

Name of Substance

  • Psammaplysin C

Systematic Name

  • 1,6-Dioxa-2-azaspiro(4.6)undeca-2,7,9-triene-3-carboxamide, 8,10-dibromo-N-(3-(2,6-dibromo-4-(1-hydroxy-2-(methylamino)ethyl)phenoxy)propyl)-4-hydroxy-9-methoxy-

Registry Numbers

CAS Registry Number

  • 142449-78-3

System Generated Number

  • 0142449783

Structure Descriptors

InChI

1S/C22H25Br4N3O7/c1-27-9-16(30)11-6-12(23)19(13(24)7-11)34-5-3-4-28-21(32)17-20(31)22(36-29-17)8-14(25)18(33-2)15(26)10-35-22/h6-7,10,16,20,27,30-31H,3-5,8-9H2,1-2H3,(H,28,32)

InChIKey

KHWOJHLZIWAPIG-UHFFFAOYSA-N

Smiles

O1N=C([C@@H]([C@@]21OC=C(C(=C(C2)Br)OC)Br)O)C(=O)NCCCOc1c(cc(cc1Br)[C@@H](CNC)O)Br