Details
| Stereochemistry | EPIMERIC |
| Molecular Formula | C52H83N7O13S |
| Molecular Weight | 1046.32 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 10 / 11 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@]([C@@H](C)CC)([C@@H](CC(=O)N1CCC[C@@]1([H])[C@H](OC)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(O)=O)OC)N(C)C(=O)[C@@H](NC(=O)[C@H](C(C)C)N(C)C(=O)CCCCCN3C(=O)CC(SC[C@H](N)C(O)=O)C3=O)C(C)C
InChI
InChIKey=BXTJCSYMGFJEID-XMTADJHZSA-N
InChI=1S/C52H83N7O13S/c1-12-32(6)45(38(71-10)27-41(61)58-25-19-22-37(58)46(72-11)33(7)47(63)54-36(52(69)70)26-34-20-15-13-16-21-34)57(9)50(66)43(30(2)3)55-48(64)44(31(4)5)56(8)40(60)23-17-14-18-24-59-42(62)28-39(49(59)65)73-29-35(53)51(67)68/h13,15-16,20-21,30-33,35-39,43-46H,12,14,17-19,22-29,53H2,1-11H3,(H,54,63)(H,55,64)(H,67,68)(H,69,70)/t32-,33+,35-,36-,37-,38+,39?,43-,44-,45-,46+/m0/s1
| Molecular Formula | C52H83N7O13S |
| Molecular Weight | 1046.32 |
| Charge | 0 |
| Count |
|
| Stereochemistry | EPIMERIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 10 / 11 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 01:34:51 GMT 2023
by
admin
on
Sat Dec 16 01:34:51 GMT 2023
|
| Record UNII |
B4S8ET206U
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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86278355
Created by
admin on Sat Dec 16 01:34:51 GMT 2023 , Edited by admin on Sat Dec 16 01:34:51 GMT 2023
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B4S8ET206U
Created by
admin on Sat Dec 16 01:34:51 GMT 2023 , Edited by admin on Sat Dec 16 01:34:51 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
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PARENT -> METABOLITE ACTIVE |
