Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C18H29NO3.C6H8O7 |
| Molecular Weight | 499.5513 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CCC(C(=O)OCCOCCN(CC)CC)C1=CC=CC=C1
InChI
InChIKey=JVKMHUAWFDGPTF-UHFFFAOYSA-N
InChI=1S/C18H29NO3.C6H8O7/c1-4-17(16-10-8-7-9-11-16)18(20)22-15-14-21-13-12-19(5-2)6-3;7-3(8)1-6(13,5(11)12)2-4(9)10/h7-11,17H,4-6,12-15H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C66917
Created by
admin on Fri Dec 15 17:35:26 UTC 2023 , Edited by admin on Fri Dec 15 17:35:26 UTC 2023
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| Code System | Code | Type | Description | ||
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242-006-8
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m2786
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admin on Fri Dec 15 17:35:26 UTC 2023 , Edited by admin on Fri Dec 15 17:35:26 UTC 2023
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100000092153
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DTXSID0046270
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CHEMBL1332546
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67HP51L98R
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SUB00911MIG
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28891
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382677
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C142976
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18109-81-4
Created by
admin on Fri Dec 15 17:35:26 UTC 2023 , Edited by admin on Fri Dec 15 17:35:26 UTC 2023
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ACTIVE MOIETY
SUBSTANCE RECORD
