Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C48H57N9O12S3 |
| Molecular Weight | 1048.214 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 12 / 12 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@](NC(=O)[C@H](N)C1=CC=CC=C1)(C(=O)N[C@@H](C(=O)N[C@]([H])(C(=O)N[C@@H](C(=O)N[C@@H]2C(=O)N3[C@@H](C(O)=O)C(C)(C)S[C@]23[H])C4=CC=CC=C4)[C@]5([H])N[C@@H](C(O)=O)C(C)(C)S5)C6=CC=CC=C6)[C@]7([H])N[C@@H](C(O)=O)C(C)(C)S7
InChI
InChIKey=CXYFUYQPFUMJDV-SFUXYWTESA-N
InChI=1S/C48H57N9O12S3/c1-46(2)31(43(64)65)55-39(70-46)28(52-34(58)25(49)22-16-10-7-11-17-22)37(61)50-26(23-18-12-8-13-19-23)35(59)53-29(40-56-32(44(66)67)47(3,4)71-40)38(62)51-27(24-20-14-9-15-21-24)36(60)54-30-41(63)57-33(45(68)69)48(5,6)72-42(30)57/h7-21,25-33,39-40,42,55-56H,49H2,1-6H3,(H,50,61)(H,51,62)(H,52,58)(H,53,59)(H,54,60)(H,64,65)(H,66,67)(H,68,69)/t25-,26-,27-,28-,29-,30-,31+,32+,33+,39-,40-,42-/m1/s1
| Molecular Formula | C48H57N9O12S3 |
| Molecular Weight | 1048.214 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 12 / 12 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 06:43:57 GMT 2023
by
admin
on
Sat Dec 16 06:43:57 GMT 2023
|
| Record UNII |
BO07V32006
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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114977-84-3
Created by
admin on Sat Dec 16 06:43:58 GMT 2023 , Edited by admin on Sat Dec 16 06:43:58 GMT 2023
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DTXSID30150906
Created by
admin on Sat Dec 16 06:43:58 GMT 2023 , Edited by admin on Sat Dec 16 06:43:58 GMT 2023
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131634605
Created by
admin on Sat Dec 16 06:43:58 GMT 2023 , Edited by admin on Sat Dec 16 06:43:58 GMT 2023
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BO07V32006
Created by
admin on Sat Dec 16 06:43:58 GMT 2023 , Edited by admin on Sat Dec 16 06:43:58 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
|
