SPORIDESMIN D

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H26ClN3O6S2
Molecular Weight	504.02
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12N(C)C3=C(OC)C(OC)=C(Cl)C=C3[C@@]1(O)[C@@H](O)[C@]4(SC)N2C(=O)[C@@](C)(SC)N(C)C4=O

InChI

InChIKey=CKKYQBFKVBEKFR-UYUBTLJZSA-N

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

HIDE SMILES / InChI

Molecular Formula	C20H26ClN3O6S2
Molecular Weight	504.02
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 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	051UM88S3X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SPORIDESMIN D

Common Name

English

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)-

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID30939475