Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C52H76O24 |
Molecular Weight | 1085.1454 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 25 / 25 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]1(C[C@@H](O)[C@H](O)[C@@H](C)O1)O[C@@H]2C[C@H](OC3=C(C)C(O)=C4C(C=C5C[C@@]([H])([C@H](OC)C(=O)[C@@H](O)[C@@H](C)O)[C@H](O[C@@]6([H])C[C@@H](O[C@@]7([H])C[C@@H](O[C@@]8([H])C[C@](C)(O)[C@H](O)[C@@H](C)O8)[C@@H](O)[C@@H](C)O7)[C@H](O)[C@@H](C)O6)C(=O)C5=C4O)=C3)O[C@H](C)[C@H]2O
InChI
InChIKey=CFCUWKMKBJTWLW-BKHRDMLASA-N
InChI=1S/C52H76O24/c1-18-29(72-34-14-30(43(58)21(4)68-34)73-33-13-28(54)42(57)20(3)67-33)12-26-10-25-11-27(49(66-9)48(63)41(56)19(2)53)50(47(62)39(25)46(61)38(26)40(18)55)76-36-16-31(44(59)23(6)70-36)74-35-15-32(45(60)22(5)69-35)75-37-17-52(8,65)51(64)24(7)71-37/h10,12,19-24,27-28,30-37,41-45,49-51,53-61,64-65H,11,13-17H2,1-9H3/t19-,20-,21-,22-,23-,24-,27+,28-,30-,31-,32-,33+,34+,35+,36+,37+,41+,42-,43-,44-,45+,49+,50+,51-,52+/m1/s1
Molecular Formula | C52H76O24 |
Molecular Weight | 1085.1454 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 25 / 25 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:02:58 UTC 2023
by
admin
on
Fri Dec 15 15:02:58 UTC 2023
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Record UNII |
NIJ123W41V
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C2115
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NCI_THESAURUS |
C67439
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WHO-ATC |
L01DC02
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WHO-VATC |
QL01DC02
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Code System | Code | Type | Description | ||
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DTXSID6023492
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CHEMBL1237054
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163659
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18378-89-7
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C658
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100000081933
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2223
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8394
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SUB09959MIG
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PLICAMYCIN
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31856
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24559
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D008926
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6995
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2029
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m8922
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DB06810
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NIJ123W41V
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3238
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Related Record | Type | Details | ||
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ACTIVE MOIETY |