Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C31H42N2O7.C4H4O4 |
Molecular Weight | 670.7465 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2CC3=C(C[C@H]2C(=O)OC(C)(C)C)C=C(OC)C(OC)=C3
InChI
InChIKey=SMLOIRKJVBQPQD-SAYMYIPQSA-N
InChI=1S/C31H42N2O7.C4H4O4/c1-8-39-29(35)24(15-14-21-12-10-9-11-13-21)32-20(2)28(34)33-19-23-18-27(38-7)26(37-6)17-22(23)16-25(33)30(36)40-31(3,4)5;5-3(6)1-2-4(7)8/h9-13,17-18,20,24-25,32H,8,14-16,19H2,1-7H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t20-,24-,25-;/m0./s1
Approval Year
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Code System | Code | Type | Description | ||
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OSM0Q2A1Y3
Created by
admin on Sat Dec 16 09:57:51 GMT 2023 , Edited by admin on Sat Dec 16 09:57:51 GMT 2023
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71750756
Created by
admin on Sat Dec 16 09:57:51 GMT 2023 , Edited by admin on Sat Dec 16 09:57:51 GMT 2023
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1445620
Created by
admin on Sat Dec 16 09:57:51 GMT 2023 , Edited by admin on Sat Dec 16 09:57:51 GMT 2023
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103733-40-0
Created by
admin on Sat Dec 16 09:57:51 GMT 2023 , Edited by admin on Sat Dec 16 09:57:51 GMT 2023
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PRIMARY |
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD