Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C53H86O22 |
Molecular Weight | 1075.2367 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 28 / 28 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]8(O[C@H]1CC[C@@]2(C)[C@@]([H])(CC[C@]3(C)[C@]2([H])CC=C4[C@]5([H])CC(C)(C)CC[C@@]5(CC[C@@]34C)C(=O)O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O)[C@]1(C)CO)OC[C@H](O)[C@H](O)[C@H]8O[C@]9([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]9O
InChI
InChIKey=GFPLPBCJRRNZHM-ICUGHKHQSA-N
InChI=1S/C53H86O22/c1-23-32(57)36(61)40(65)44(70-23)74-42-33(58)26(56)20-68-46(42)73-31-11-12-49(4)29(50(31,5)22-55)10-13-52(7)30(49)9-8-24-25-18-48(2,3)14-16-53(25,17-15-51(24,52)6)47(67)75-45-41(66)38(63)35(60)28(72-45)21-69-43-39(64)37(62)34(59)27(19-54)71-43/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36+,37-,38-,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL612482 Sources: https://www.ncbi.nlm.nih.gov/pubmed/19152225 |
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Target ID: CHEMBL353 Sources: https://www.ncbi.nlm.nih.gov/pubmed/19152225 |
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Target ID: CHEMBL348 Sources: https://www.ncbi.nlm.nih.gov/pubmed/19152225 |
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Code System | Code | Type | Description | ||
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21627940
Created by
admin on Sat Dec 16 10:27:40 GMT 2023 , Edited by admin on Sat Dec 16 10:27:40 GMT 2023
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PRIMARY | |||
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33289-85-9
Created by
admin on Sat Dec 16 10:27:40 GMT 2023 , Edited by admin on Sat Dec 16 10:27:40 GMT 2023
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E5H3T7090C
Created by
admin on Sat Dec 16 10:27:40 GMT 2023 , Edited by admin on Sat Dec 16 10:27:40 GMT 2023
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PRIMARY |
SUBSTANCE RECORD