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Substance Name: Actinoplanone E
RN: 116229-70-0
InChIKey: RXQNODYVXOZZIK-UHFFFAOYSA-N

Note

  • From Actinoplanes sp. R-304.

Molecular Formula

  • C31-H29-Cl-N2-O10

Molecular Weight

  • 625.027
 
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Names and Synonyms

Name of Substance

  • Actinoplanone E

Systematic Name

  • 1H-Xantheno(4',3',2':4,5)(1,3)benzodioxino(7,6-g)isoquinoline-14,17(2H,9H)-dione, 11-chloro-3,4,8a,13-tetrahydro-3,15,16-trihydroxy-1,4-dimethoxy-12-methyl-13-((1-methylethylidene)amino)-, (1S-(1alpha,3alpha,4beta,8aalpha))-

Registry Numbers

CAS Registry Number

  • 116229-70-0

System Generated Number

  • 0116229700

Structure Descriptors

InChI

1S/C31H29ClN2O10/c1-10(2)33-34-11(3)23(32)13-6-12-7-16-19-21(17(12)24(36)18(13)31(34)39)26(38)22-25(37)20-15(40-4)8-14(35)27(41-5)29(20)44-30(22)28(19)43-9-42-16/h6,14-16,27,35-36,38H,7-9H2,1-5H3

InChIKey

RXQNODYVXOZZIK-UHFFFAOYSA-N

Smiles

c1(c2cc3C[C@@H]4OCOc5c6oc7c(c(c6c(c(c45)c3c(c2c(n(\N=C(/C)C)c1C)=O)O)O)=O)[C@@H](C[C@@H]([C@@H]7OC)O)OC)Cl