Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C55H84N20O21S2 |
| Molecular Weight | 1425.507 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 19 / 19 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@]6(O[C@@H]1[C@H](O[C@H]([C@H](NC(=O)C2=NC(=NC(N)=C2C)[C@H](CC(N)=O)NC[C@H](N)C(N)=O)C(=O)N[C@H](C)[C@@H](O)[C@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCCC3=NC(=CS3)C4=NC(=CS4)C(=O)NCCCCNC(N)=N)C5=CN=CN5)O[C@@H](CO)[C@@H](O)[C@@H]1O)O[C@H](CO)[C@@H](O)[C@H](OC(N)=O)[C@@H]6O
InChI
InChIKey=NBLHOLNNKJBEDC-XOGQCRKLSA-N
InChI=1S/C55H84N20O21S2/c1-19-32(72-45(75-43(19)58)24(11-30(57)79)67-12-23(56)44(59)85)49(89)74-34(40(25-13-63-18-68-25)94-53-42(38(83)36(81)28(14-76)93-53)95-52-39(84)41(96-55(62)91)37(82)29(15-77)92-52)50(90)69-21(3)35(80)20(2)46(86)73-33(22(4)78)48(88)65-10-7-31-70-27(17-97-31)51-71-26(16-98-51)47(87)64-8-5-6-9-66-54(60)61/h13,16-18,20-24,28-29,33-42,52-53,67,76-78,80-84H,5-12,14-15,56H2,1-4H3,(H2,57,79)(H2,59,85)(H2,62,91)(H,63,68)(H,64,87)(H,65,88)(H,69,90)(H,73,86)(H,74,89)(H2,58,72,75)(H4,60,61,66)/t20-,21+,22+,23-,24-,28-,29+,33-,34-,35-,36+,37+,38-,39-,40-,41-,42-,52+,53-/m0/s1
| Molecular Formula | C55H84N20O21S2 |
| Molecular Weight | 1425.507 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 19 / 19 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:01:57 UTC 2023
by
admin
on
Fri Dec 15 16:01:57 UTC 2023
|
| Record UNII |
M62KK37O40
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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Common Name | English | ||
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| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C2311
Created by
admin on Fri Dec 15 16:01:58 UTC 2023 , Edited by admin on Fri Dec 15 16:01:58 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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C81672
Created by
admin on Fri Dec 15 16:01:58 UTC 2023 , Edited by admin on Fri Dec 15 16:01:58 UTC 2023
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PRIMARY | |||
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9060-10-0
Created by
admin on Fri Dec 15 16:01:57 UTC 2023 , Edited by admin on Fri Dec 15 16:01:57 UTC 2023
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5496540
Created by
admin on Fri Dec 15 16:01:58 UTC 2023 , Edited by admin on Fri Dec 15 16:01:58 UTC 2023
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DTXSID80872328
Created by
admin on Fri Dec 15 16:01:57 UTC 2023 , Edited by admin on Fri Dec 15 16:01:57 UTC 2023
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PRIMARY | |||
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M62KK37O40
Created by
admin on Fri Dec 15 16:01:58 UTC 2023 , Edited by admin on Fri Dec 15 16:01:58 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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SALT/SOLVATE -> PARENT |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
