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Substance Name: Calphostin A
RN: 120461-92-9
InChIKey: DTYXTBFGOFPLIJ-UHFFFAOYSA-N

Note

  • Isolated from Cladosporium cladosporioides.

Molecular Formula

  • C44-H38-O12

Molecular Weight

  • 758.772
 
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Names and Synonyms

Name of Substance

  • Calphostin A

Synonym

  • Ucn 1028 A

Systematic Name

  • 3,10-Perylenedione, 1,12-bis(2-(benzoyloxy)propyl)-4,9-dihydroxy-2,6,7,11-tetramethoxy-

Registry Numbers

CAS Registry Number

  • 120461-92-9

System Generated Number

  • 0120461929

Structure Descriptors

InChI

1S/C44H38O12/c1-21(55-43(49)23-13-9-7-10-14-23)17-25-31-32-26(18-22(2)56-44(50)24-15-11-8-12-16-24)42(54-6)40(48)34-28(46)20-30(52-4)36(38(32)34)35-29(51-3)19-27(45)33(37(31)35)39(47)41(25)53-5/h7-16,19-22,45-46H,17-18H2,1-6H3

InChIKey

DTYXTBFGOFPLIJ-UHFFFAOYSA-N

Smiles

c1(c(c(c2c(cc(c3c4c(cc(c5c(c(c(c(c45)c1c23)C[C@@H](C)OC(c1ccccc1)=O)OC)=O)O)OC)OC)O)=O)OC)C[C@@H](C)OC(c1ccccc1)=O