Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C38H44O8.C5H5N |
| Molecular Weight | 707.8511 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C1=CC=NC=C1.CC(C)=CCC[C@@]2(C)OC3=C(CC=C(C)C)C4=C(C(=O)C5=C[C@@H]6C[C@H]7C(C)(C)O[C@@](C\C=C(\C)C(O)=O)(C6=O)[C@@]57O4)C(O)=C3C=C2
InChI
InChIKey=BKGYWOJFASUDOZ-WDEBETKRSA-N
InChI=1S/C38H44O8.C5H5N/c1-20(2)10-9-15-36(8)16-14-24-29(39)28-30(40)26-18-23-19-27-35(6,7)46-37(33(23)41,17-13-22(5)34(42)43)38(26,27)45-32(28)25(31(24)44-36)12-11-21(3)4;1-2-4-6-5-3-1/h10-11,13-14,16,18,23,27,39H,9,12,15,17,19H2,1-8H3,(H,42,43);1-5H/b22-13-;/t23-,27+,36-,37+,38-;/m1./s1
| Molecular Formula | C38H44O8 |
| Molecular Weight | 628.7512 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C5H5N |
| Molecular Weight | 79.0999 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 22:07:13 GMT 2025
by
admin
on
Mon Mar 31 22:07:13 GMT 2025
|
| Record UNII |
6BXS043CRG
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Common Name | English | ||
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Preferred Name | English | ||
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m5661
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admin on Mon Mar 31 22:07:13 GMT 2025 , Edited by admin on Mon Mar 31 22:07:13 GMT 2025
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PRIMARY | Merck Index | ||
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73425387
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2631-91-6
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admin on Mon Mar 31 22:07:13 GMT 2025 , Edited by admin on Mon Mar 31 22:07:13 GMT 2025
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6BXS043CRG
Created by
admin on Mon Mar 31 22:07:13 GMT 2025 , Edited by admin on Mon Mar 31 22:07:13 GMT 2025
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