Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C48H52N8O8 |
| Molecular Weight | 868.9753 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC(=O)N[C@@H](C(C)C)C(=O)N1[C@@H](C)CC[C@H]1C2=NC3=C(N2)C4=C(C=C3)C=C5C(OCC6=CC(=CC=C56)C7=CN=C(N7)[C@@H]8C[C@H](CO)CN8C(=O)[C@H](NC(=O)OC)C9=CC=CC=C9)=C4
InChI
InChIKey=BWMQSUSKFWWQJQ-ZSMILFTGSA-N
InChI=1S/C48H52N8O8/c1-25(2)40(53-47(60)62-4)46(59)56-26(3)11-16-37(56)44-50-35-15-13-29-19-34-32-14-12-30(18-31(32)24-64-39(34)20-33(29)42(35)52-44)36-21-49-43(51-36)38-17-27(23-57)22-55(38)45(58)41(54-48(61)63-5)28-9-7-6-8-10-28/h6-10,12-15,18-21,25-27,37-38,40-41,57H,11,16-17,22-24H2,1-5H3,(H,49,51)(H,50,52)(H,53,60)(H,54,61)/t26-,27-,37-,38-,40-,41+/m0/s1
| Molecular Formula | C48H52N8O8 |
| Molecular Weight | 868.9753 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 13:33:26 GMT 2023
by
admin
on
Sat Dec 16 13:33:26 GMT 2023
|
| Record UNII |
ZT4QPD8LUB
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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| Code System | Code | Type | Description | ||
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ZT4QPD8LUB
Created by
admin on Sat Dec 16 13:33:26 GMT 2023 , Edited by admin on Sat Dec 16 13:33:26 GMT 2023
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PRIMARY | |||
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2171136-71-1
Created by
admin on Sat Dec 16 13:33:26 GMT 2023 , Edited by admin on Sat Dec 16 13:33:26 GMT 2023
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142307971
Created by
admin on Sat Dec 16 13:33:26 GMT 2023 , Edited by admin on Sat Dec 16 13:33:26 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
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PARENT -> METABOLITE |
