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Details

Stereochemistry MIXED
Molecular Formula C18H20ClN3O6S3
Molecular Weight 506.016
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SPORIDESMIN E

SMILES

COC1=C(OC)C(Cl)=CC2=C1N(C)C3N4C(=O)C5(C)SSSC4(C(O)C23O)C(=O)N5C

InChI

InChIKey=NAEONKBZNXPTMI-UHFFFAOYSA-N
InChI=1S/C18H20ClN3O6S3/c1-16-14(24)22-13-17(26,12(23)18(22,30-31-29-16)15(25)21(16)3)7-6-8(19)10(27-4)11(28-5)9(7)20(13)2/h6,12-13,23,26H,1-5H3

HIDE SMILES / InChI

Molecular Formula C18H20ClN3O6S3
Molecular Weight 506.016
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:43:26 GMT 2023
Edited
by admin
on Fri Dec 15 19:43:26 GMT 2023
Record UNII
7E8A3B9UZJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SPORIDESMIN E
Common Name English
(±)-SPORIDESMIN E
Common Name English
SPORIDESMIN E, (+/)-
Common Name English
4,12A-(IMINOMETHANO)-12AH-(1,2,3,5)TRITHIAZEPINO(5',4':1,5)PYRROLO(2,3-B)INDOLE-5,13(4H)-DIONE, 10-CHLORO-6A,7,11B,12-TETRAHYDRO-11B,12-DIHYDROXY-8,9-DIMETHOXY-4,7,14-TRIMETHYL-
Common Name English
Code System Code Type Description
CAS
22327-77-1
Created by admin on Fri Dec 15 19:43:26 GMT 2023 , Edited by admin on Fri Dec 15 19:43:26 GMT 2023
PRIMARY
MESH
C001873
Created by admin on Fri Dec 15 19:43:26 GMT 2023 , Edited by admin on Fri Dec 15 19:43:26 GMT 2023
PRIMARY
EPA CompTox
DTXSID00944975
Created by admin on Fri Dec 15 19:43:26 GMT 2023 , Edited by admin on Fri Dec 15 19:43:26 GMT 2023
PRIMARY
FDA UNII
7E8A3B9UZJ
Created by admin on Fri Dec 15 19:43:26 GMT 2023 , Edited by admin on Fri Dec 15 19:43:26 GMT 2023
PRIMARY
PUBCHEM
3084369
Created by admin on Fri Dec 15 19:43:26 GMT 2023 , Edited by admin on Fri Dec 15 19:43:26 GMT 2023
PRIMARY