Stereochemistry | ABSOLUTE |
Molecular Formula | C27H30ClN5O12S3 |
Molecular Weight | 748.201 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=NOC(NS(=O)(=O)C2=C(SC=C2)C(=O)CC3=C(C)C=C(O)C(O)=C3SC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O)=C1Cl
InChI
InChIKey=SVBBZUSELHPUJQ-GJZGRUSLSA-N
InChI=1S/C27H30ClN5O12S3/c1-11-7-16(34)22(39)23(47-10-15(25(40)30-9-20(37)38)31-19(36)4-3-14(29)27(41)42)13(11)8-17(35)24-18(5-6-46-24)48(43,44)33-26-21(28)12(2)32-45-26/h5-7,14-15,33-34,39H,3-4,8-10,29H2,1-2H3,(H,30,40)(H,31,36)(H,37,38)(H,41,42)/t14-,15-/m0/s1
Molecular Formula | C27H30ClN5O12S3 |
Molecular Weight | 748.201 |
Charge | 0 |
Count |
MOL RATIO
1 MOL RATIO (average) |
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |