Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C14H13O3.Na |
| Molecular Weight | 252.241 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].COC1=CC2=CC=C(C=C2C=C1)[C@H](C)C([O-])=O
InChI
InChIKey=CDBRNDSHEYLDJV-FVGYRXGTSA-M
InChI=1S/C14H14O3.Na/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10;/h3-9H,1-2H3,(H,15,16);/q;+1/p-1/t9-;/m0./s1
Approval Year
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NCI_THESAURUS |
C1323
Created by
admin on Fri Dec 15 15:20:18 UTC 2023 , Edited by admin on Fri Dec 15 15:20:18 UTC 2023
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142442
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m7769
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247-486-2
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SUB166156
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C48006
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SUB03392MIG
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1457403
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26159-34-2
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23681059
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CHEMBL154
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100000092256
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9TN87S3A3C
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DTXSID7045576
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9TN87S3A3C
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ACTIVE MOIETY
SUBSTANCE RECORD
