Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C40H44N4O10S |
| Molecular Weight | 772.863 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC2=C(NC3=C2CCN[C@]34CS[C@H]5[C@H]6[C@@H]7N(C)[C@@H](CC8=CC(C)=C(OC)C(O)=C78)[C@H](O)N6[C@@H](COC4=O)C9=C(O)C(O)=C(C)C(OC(C)=O)=C59)C=C1
InChI
InChIKey=MHPHVBHUGGIALW-HPTGFVDJSA-N
InChI=1S/C40H44N4O10S/c1-16-11-19-12-24-38(49)44-25-14-53-39(50)40(37-21(9-10-41-40)22-13-20(51-5)7-8-23(22)42-37)15-55-36(30(44)29(43(24)4)26(19)33(48)34(16)52-6)28-27(25)32(47)31(46)17(2)35(28)54-18(3)45/h7-8,11,13,24-25,29-30,36,38,41-42,46-49H,9-10,12,14-15H2,1-6H3/t24-,25-,29+,30+,36+,38-,40+/m0/s1
| Molecular Formula | C40H44N4O10S |
| Molecular Weight | 772.863 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 08:49:38 GMT 2025
by
admin
on
Wed Apr 02 08:49:38 GMT 2025
|
| Record UNII |
SPI9H51GW7
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Preferred Name | English |
| Code System | Code | Type | Description | ||
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SPI9H51GW7
Created by
admin on Wed Apr 02 08:49:38 GMT 2025 , Edited by admin on Wed Apr 02 08:49:38 GMT 2025
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PRIMARY | |||
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154733422
Created by
admin on Wed Apr 02 08:49:38 GMT 2025 , Edited by admin on Wed Apr 02 08:49:38 GMT 2025
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PRIMARY |
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PARENT -> METABOLITE |
MAJOR
FECAL; PLASMA; URINE
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