Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C45H72O12 |
Molecular Weight | 805.046 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 18 / 18 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC[C@@H]1CC[C@@H]2O[C@@]3(O[C@@H](C[C@@H](C)O)[C@@H](C)CC3=O)[C@@H](C)[C@H](OC(=O)\C=C\[C@H](C)[C@@H](O)[C@H](C)C(=O)[C@H](C)[C@@H](O)[C@H](C)C(=O)[C@](C)(O)[C@@H](O)[C@H](C)C\C=C\C=C\1)[C@@H]2C
InChI
InChIKey=QPRQJOHKNJIMGN-WVUAJZTGSA-N
InChI=1S/C45H72O12/c1-12-33-17-15-13-14-16-25(3)42(52)44(11,54)43(53)31(9)40(51)30(8)39(50)29(7)38(49)24(2)18-21-37(48)55-41-28(6)34(20-19-33)56-45(32(41)10)36(47)22-26(4)35(57-45)23-27(5)46/h13-15,17-18,21,24-35,38,40-42,46,49,51-52,54H,12,16,19-20,22-23H2,1-11H3/b14-13+,17-15+,21-18+/t24-,25+,26-,27+,28+,29-,30-,31-,32-,33-,34-,35-,38+,40+,41+,42-,44+,45+/m0/s1
Molecular Formula | C45H72O12 |
Molecular Weight | 805.046 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 18 / 18 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 19:13:48 GMT 2023
by
admin
on
Fri Dec 15 19:13:48 GMT 2023
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Record UNII |
387OE420H7
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Record Status |
Validated (UNII)
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Record Version |
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-
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C048335
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387OE420H7
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76958645
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234-275-5
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DTXSID301017534
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11050-94-5
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717695
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m8197
Created by
admin on Fri Dec 15 19:13:48 GMT 2023 , Edited by admin on Fri Dec 15 19:13:48 GMT 2023
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PRIMARY | Merck Index |