Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C18H29NO3.C6H8O7 |
Molecular Weight | 499.5513 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CC[C@@H](C(=O)OCCOCCN(CC)CC)C1=CC=CC=C1
InChI
InChIKey=JVKMHUAWFDGPTF-UNTBIKODSA-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)/t17-;/m1./s1
Approval Year
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Code | English | ||
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Code | English |
Code System | Code | Type | Description | ||
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DV28EGS2QW
Created by
admin on Sat Dec 16 10:22:12 GMT 2023 , Edited by admin on Sat Dec 16 10:22:12 GMT 2023
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PRIMARY | |||
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76960530
Created by
admin on Sat Dec 16 10:22:12 GMT 2023 , Edited by admin on Sat Dec 16 10:22:12 GMT 2023
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PRIMARY |
SUBSTANCE RECORD