Sporidesmin D

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Sporidesmin D

Names

Structural Information

Physico-chemical Properties

ADME

Toxicity

Medical Chemistry

Fungi

Mycotoxin name: Sporidesmin D
First synonym: None
Synonyms: Sporidesmin D,UNII-051UM88S3X,051UM88S3X,18180-71-7,2H-Pyrazino(1',2':1,5)pyrrolo(2,3-b)indole-1,4(3H,5aH)-dione, 9-chloro-6,10b,11,11a-tetrahydro-10b,11-dihydroxy-7,8-dimethoxy-2,3,6-trimethyl-3,11a-bis(methylthio)-,2H-PYRAZINO(1',2':1,5)PYRROLO(2,3-B)INDOLE-1,4(3H,5AH)-DIONE, 9-CHLORO-6,10B,11,11A-TETRAHYDRO-10B,11-DIHYDROXY-7,8-DIMETHOXY-2,3,6-TRIMETHYL-3,11A-BIS(METHYLTHIO)-, (3R,5AR,10BS,11R,11AR)-,(1R,4R,7R,8R,9S)-12-chloro-8,9-dihydroxy-13,14-dimethoxy-4,5,16-trimethyl-4,7-bis(methylsulfanyl)-2,5,16-triazatetracyclo(7.7.0.02,7.010,15)hexadeca-10,12,14-triene-3,6-dione,(1R,4R,7R,8R,9S)-12-chloro-8,9-dihydroxy-13,14-dimethoxy-4,5,16-trimethyl-4,7-bis(methylsulfanyl)-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-triene-3,6-dione,CHEBI:219293,Q27236058,(1R,4R,7R,8R,9S)-12-chloro-8,9-dihydroxy-13,14-dimethoxy-4,5,16-trimethyl-4,7-bis(methylsulanyl)-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-triene-3,6-dione

Smiles: CC1(C(=O)N2C3C(C(C2(C(=O)N1C)SC)O)(C4=CC(=C(C(=C4N3C)OC)OC)Cl)O)SC
Isomeric smiles: C[C@]1(C(=O)N2[C@@H]3[C@]([C@H]([C@]2(C(=O)N1C)SC)O)(C4=CC(=C(C(=C4N3C)OC)OC)Cl)O)SC
Inchi: InChI=1S/C20H26ClN3O6S2/c1-18(31-6)16(26)24-15-19(28,14(25)20(24,32-7)17(27)23(18)3)9-8-10(21)12(29-4)13(30-5)11(9)22(15)2/h8,14-15,25,28H,1-7H3/t14-,15-,18-,19-,20-/m1/s1
Inchikey: CKKYQBFKVBEKFR-UYUBTLJZSA-N

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