Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C44H69NO12 |
| Molecular Weight | 804.0182 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 14 / 14 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CO[C@@H]1C[C@@H](CC[C@H]1O)\C=C(/C)[C@@H](O)[C@H](C)[C@@H]2CC(=O)[C@H](CC=C)\C=C(C)\C[C@H](C)C[C@H](OC)[C@H]3O[C@](O)([C@H](C)C[C@@H]3OC)C(=O)C(=O)N4CCCC[C@H]4C(=O)O2
InChI
InChIKey=YXGKFJMGANONSQ-YSAQBHCASA-N
InChI=1S/C44H69NO12/c1-10-13-31-19-25(2)18-26(3)20-37(54-8)40-38(55-9)22-28(5)44(52,57-40)41(49)42(50)45-17-12-11-14-32(45)43(51)56-35(24-34(31)47)29(6)39(48)27(4)21-30-15-16-33(46)36(23-30)53-7/h10,19,21,26,28-33,35-40,46,48,52H,1,11-18,20,22-24H2,2-9H3/b25-19+,27-21+/t26-,28+,29+,30-,31+,32-,33+,35-,36+,37-,38-,39+,40+,44+/m0/s1
| Molecular Formula | C44H69NO12 |
| Molecular Weight | 804.0182 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 14 / 14 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 11:49:01 GMT 2025
by
admin
on
Wed Apr 02 11:49:01 GMT 2025
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| Record UNII |
AP3VG6M3W4
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| Record Status |
Validated (UNII)
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| Record Version |
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AP3VG6M3W4
Created by
admin on Wed Apr 02 11:49:01 GMT 2025 , Edited by admin on Wed Apr 02 11:49:01 GMT 2025
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PARENT -> IMPURITY |
MINOR
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