Stereochemistry | ABSOLUTE |
Molecular Formula | 2C13H21NO3.H2O4S |
Molecular Weight | 576.7 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.CC(C)(C)NC[C@H](O)C1=CC(CO)=C(O)C=C1.CC(C)(C)NC[C@H](O)C2=CC(CO)=C(O)C=C2
InChI
InChIKey=BNPSSFBOAGDEEL-NMFAMCKASA-N
InChI=1S/2C13H21NO3.H2O4S/c2*1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15;1-5(2,3)4/h2*4-6,12,14-17H,7-8H2,1-3H3;(H2,1,2,3,4)/t2*12-;/m00./s1