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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H34N6O8S2
Molecular Weight 598.692
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of KW-2149

SMILES

CO[C@]12[C@H]3N[C@H]3CN1C4=C([C@H]2COC(N)=O)C(=O)C(NCCSSCCNC(=O)CC[C@H](N)C(O)=O)=C(C)C4=O

InChI

InChIKey=BIOSTZMAOGCGSC-CYUGEGSCSA-N
InChI=1S/C24H34N6O8S2/c1-11-17(28-6-8-40-39-7-5-27-15(31)4-3-13(25)22(34)35)20(33)16-12(10-38-23(26)36)24(37-2)21-14(29-21)9-30(24)18(16)19(11)32/h12-14,21,28-29H,3-10,25H2,1-2H3,(H2,26,36)(H,27,31)(H,34,35)/t12-,13+,14+,21+,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H34N6O8S2
Molecular Weight 598.692
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
AK8DKI0KMN
Record Status Validated (UNII)
Record Version