Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C44H69NO13 |
| Molecular Weight | 820.0176 |
| 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]2OC(=O)[C@@H]3CCCCN3C(=O)C(=O)[C@]4(O)O[C@@H]([C@H](C[C@H]4C)OC)[C@H](C[C@@H](C)C\C(C)=C\[C@@H](CC(C)=O)C(=O)C[C@H](O)[C@H]2C)OC
InChI
InChIKey=DHEMNTLAGYUASY-BABZEESQSA-N
InChI=1S/C44H69NO13/c1-24-16-25(2)18-37(55-8)40-38(56-9)20-27(4)44(53,58-40)41(50)42(51)45-15-11-10-12-32(45)43(52)57-39(26(3)19-30-13-14-33(47)36(22-30)54-7)29(6)34(48)23-35(49)31(17-24)21-28(5)46/h17,19,25,27,29-34,36-40,47-48,53H,10-16,18,20-23H2,1-9H3/b24-17+,26-19+/t25-,27+,29+,30-,31-,32-,33+,34-,36+,37-,38-,39+,40+,44+/m0/s1
| Molecular Formula | C44H69NO13 |
| Molecular Weight | 820.0176 |
| 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
Mon Mar 31 18:07:12 GMT 2025
by
admin
on
Mon Mar 31 18:07:12 GMT 2025
|
| Record UNII |
K0Z8830U95
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| Record Status |
Validated (UNII)
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| Record Version |
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124554-37-6
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9811140
Created by
admin on Mon Mar 31 18:07:12 GMT 2025 , Edited by admin on Mon Mar 31 18:07:12 GMT 2025
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K0Z8830U95
Created by
admin on Mon Mar 31 18:07:12 GMT 2025 , Edited by admin on Mon Mar 31 18:07:12 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE ISOMER -> PARENT |