Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C49H76O19 |
| Molecular Weight | 969.1163 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 25 / 25 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@H](CC[C@]34O)C5=CC(=O)OC5)[C@@]1(C)CC[C@@H](C2)O[C@H]6C[C@H](O)[C@H](O[C@H]7C[C@H](O)[C@H](O[C@H]8C[C@H](OC(C)=O)[C@H](O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@@H](C)O8)[C@@H](C)O7)[C@@H](C)O6
InChI
InChIKey=YFGQJKBUXPKSAW-YSTAXILLSA-N
InChI=1S/C49H76O19/c1-22-43(66-38-18-33(53)44(23(2)61-38)67-39-19-34(63-25(4)51)45(24(3)62-39)68-46-42(57)41(56)40(55)35(20-50)65-46)32(52)17-37(60-22)64-28-9-12-47(5)27(16-28)7-8-31-30(47)10-13-48(6)29(11-14-49(31,48)58)26-15-36(54)59-21-26/h15,22-24,27-35,37-46,50,52-53,55-58H,7-14,16-21H2,1-6H3/t22-,23-,24-,27-,28+,29-,30+,31-,32+,33+,34+,35-,37+,38+,39+,40-,41+,42-,43-,44-,45-,46+,47+,48-,49+/m1/s1
| Molecular Formula | C49H76O19 |
| Molecular Weight | 969.1163 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 25 / 25 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 08:38:54 GMT 2023
by
admin
on
Sat Dec 16 08:38:54 GMT 2023
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| Record UNII |
H4BU39831E
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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7532
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H4BU39831E
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241-544-0
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17575-20-1
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admin on Sat Dec 16 08:38:54 GMT 2023 , Edited by admin on Sat Dec 16 08:38:54 GMT 2023
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m6674
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admin on Sat Dec 16 08:38:54 GMT 2023 , Edited by admin on Sat Dec 16 08:38:54 GMT 2023
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PRIMARY | Merck Index | ||
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DTXSID7023196
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10819737
Created by
admin on Sat Dec 16 08:38:54 GMT 2023 , Edited by admin on Sat Dec 16 08:38:54 GMT 2023
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