Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C55H83N17O21S3 |
| Molecular Weight | 1414.544 |
| 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)NCCC[S+](C)C)C5=CN=C[N-]5)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=OYVAGSVQBOHSSS-UAPAGMARSA-N
InChI=1S/C55H83N17O21S3/c1-20-33(69-46(72-44(20)58)25(12-31(57)76)64-13-24(56)45(59)82)50(86)71-35(41(26-14-61-19-65-26)91-54-43(39(80)37(78)29(15-73)90-54)92-53-40(81)42(93-55(60)88)38(79)30(16-74)89-53)51(87)66-22(3)36(77)21(2)47(83)70-34(23(4)75)49(85)63-10-8-32-67-28(18-94-32)52-68-27(17-95-52)48(84)62-9-7-11-96(5)6/h14,17-19,21-25,29-30,34-43,53-54,64,73-75,77-81H,7-13,15-16,56H2,1-6H3,(H13-,57,58,59,60,61,62,63,65,66,69,70,71,72,76,82,83,84,85,86,87,88)/t21-,22+,23+,24-,25-,29-,30+,34-,35-,36-,37+,38+,39-,40-,41-,42-,43-,53+,54-/m0/s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C2311
Created by
admin on Fri Dec 15 16:36:54 UTC 2023 , Edited by admin on Fri Dec 15 16:36:54 UTC 2023
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| Code System | Code | Type | Description | ||
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11672633
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11116-31-7
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100000136583
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SUB74829
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13M89UEA7W
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DTXSID20872327
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234-356-5
Created by
admin on Fri Dec 15 16:36:54 UTC 2023 , Edited by admin on Fri Dec 15 16:36:54 UTC 2023
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3139
Created by
admin on Fri Dec 15 16:36:54 UTC 2023 , Edited by admin on Fri Dec 15 16:36:54 UTC 2023
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C311
Created by
admin on Fri Dec 15 16:36:54 UTC 2023 , Edited by admin on Fri Dec 15 16:36:54 UTC 2023
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m2589
Created by
admin on Fri Dec 15 16:36:54 UTC 2023 , Edited by admin on Fri Dec 15 16:36:54 UTC 2023
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PRIMARY | Merck Index |
ACTIVE MOIETY
SALT/SOLVATE (PARENT)