Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C13H19O5P.2Na |
| Molecular Weight | 332.2403 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].CC(C)C1=CC=CC(C(C)C)=C1OCOP([O-])([O-])=O
InChI
InChIKey=LWYLQNWMSGFCOZ-UHFFFAOYSA-L
InChI=1S/C13H21O5P.2Na/c1-9(2)11-6-5-7-12(10(3)4)13(11)17-8-18-19(14,15)16;;/h5-7,9-10H,8H2,1-4H3,(H2,14,15,16);;/q;2*+1/p-2
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C245
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SUB32986
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ACTIVE MOIETY
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD