Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C33H35N2O5.Ca |
| Molecular Weight | 1119.361 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C3=CC=CC=C3)C4=CC=CC=C4.CC(C)C5=C(C(=O)NC6=CC=CC=C6)C(=C(N5CC[C@@H](O)C[C@@H](O)CC([O-])=O)C7=CC=CC=C7)C8=CC=CC=C8
InChI
InChIKey=ILJBDHBNPXANQZ-MNSAWQCASA-L
InChI=1S/2C33H36N2O5.Ca/c2*1-22(2)31-30(33(40)34-25-16-10-5-11-17-25)29(23-12-6-3-7-13-23)32(24-14-8-4-9-15-24)35(31)19-18-26(36)20-27(37)21-28(38)39;/h2*3-17,22,26-27,36-37H,18-21H2,1-2H3,(H,34,40)(H,38,39);/q;;+2/p-2/t2*26-,27-;/m11./s1
Approval Year
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| Code System | Code | Type | Description | ||
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92135123
Created by
admin on Wed Apr 02 21:23:36 GMT 2025 , Edited by admin on Wed Apr 02 21:23:36 GMT 2025
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PRIMARY | |||
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433289-83-9
Created by
admin on Wed Apr 02 21:23:36 GMT 2025 , Edited by admin on Wed Apr 02 21:23:36 GMT 2025
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PRIMARY | |||
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M5BL8F2YW6
Created by
admin on Wed Apr 02 21:23:36 GMT 2025 , Edited by admin on Wed Apr 02 21:23:36 GMT 2025
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PRIMARY |
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
