Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C38H41N3O11S |
| Molecular Weight | 747.811 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12[C@@H]3SC[C@]4(NCCC5=CC(O)=C(O)C=C45)C(=O)OC[C@H](N1[C@@H](O)[C@@H]6CC7=CC(C)=C(OC)C(O)=C7[C@H]2N6C)C8=C3C(OC(C)=O)=C(C)C9=C8OCO9
InChI
InChIKey=SEGZXEPQDIKMHQ-BUURXMNCSA-N
InChI=1S/C38H41N3O11S/c1-15-8-19-9-21-36(46)41-22-12-49-37(47)38(20-11-24(44)23(43)10-18(20)6-7-39-38)13-53-35(29(41)28(40(21)4)25(19)30(45)31(15)48-5)27-26(22)34-33(50-14-51-34)16(2)32(27)52-17(3)42/h8,10-11,21-22,28-29,35-36,39,43-46H,6-7,9,12-14H2,1-5H3/t21-,22-,28+,29+,35+,36-,38+/m0/s1
| Molecular Formula | C38H41N3O11S |
| Molecular Weight | 747.811 |
| 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
Sat Dec 16 15:13:06 GMT 2023
by
admin
on
Sat Dec 16 15:13:06 GMT 2023
|
| Record UNII |
FH953C3STD
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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FH953C3STD
Created by
admin on Sat Dec 16 15:13:06 GMT 2023 , Edited by admin on Sat Dec 16 15:13:06 GMT 2023
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PRIMARY | |||
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156596924
Created by
admin on Sat Dec 16 15:13:06 GMT 2023 , Edited by admin on Sat Dec 16 15:13:06 GMT 2023
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DBMET01136
Created by
admin on Sat Dec 16 15:13:06 GMT 2023 , Edited by admin on Sat Dec 16 15:13:06 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
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