Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C45H55NO14 |
Molecular Weight | 833.9165 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 12 / 12 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12C[C@H](O)[C@@]3(C)C(=O)[C@H](OC(C)=O)C4=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)C5=CC=CC=C5)[C@]3([H])[C@@]1(CO2)OC(C)=O)C4(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)[C@@H](C)CC)C6=CC=CC=C6
InChI
InChIKey=OKEKLOJNCOIPIT-RLNDXAGLSA-N
InChI=1S/C45H55NO14/c1-9-23(2)39(52)46-33(27-16-12-10-13-17-27)34(50)41(54)58-29-21-45(55)38(59-40(53)28-18-14-11-15-19-28)36-43(8,30(49)20-31-44(36,22-56-31)60-26(5)48)37(51)35(57-25(4)47)32(24(29)3)42(45,6)7/h10-19,23,29-31,33-36,38,49-50,55H,9,20-22H2,1-8H3,(H,46,52)/t23-,29-,30-,31+,33-,34+,35+,36-,38-,43+,44-,45+/m0/s1
Molecular Formula | C45H55NO14 |
Molecular Weight | 833.9165 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 12 / 12 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:28:40 GMT 2023
by
admin
on
Sat Dec 16 19:28:40 GMT 2023
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Record UNII |
HLD2E3A9WD
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Record Status |
Validated (UNII)
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Record Version |
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-
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158948-96-0
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166451433
Created by
admin on Sat Dec 16 19:28:40 GMT 2023 , Edited by admin on Sat Dec 16 19:28:40 GMT 2023
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HLD2E3A9WD
Created by
admin on Sat Dec 16 19:28:40 GMT 2023 , Edited by admin on Sat Dec 16 19:28:40 GMT 2023
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Related Record | Type | Details | ||
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PARENT -> IMPURITY |
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