| Predicate | Object |
|---|---|
| rdf:type | |
| chemicalCompound:parent | |
| chemicalCompound:synonym | |
| chemicalCompound:standardIn... |
InChI=1S/C66H75Cl2N9O24.ClH/c1-23(2)12-34(71-5)58(88)76-49-51(83)26-7-10-38(32(67)14-26)97-40-16-28-17-41(55(40)101-65-56(54(86)53(85)42(22-78)99-65)100-44-21-66(4,70)57(87)24(3)96-44)98-39-11-8-27(15-33(39)68)52(84)50-63(93)75-48(64(94)95)31-18-29(79)19-37(81)45(31)30-13-25(6-9-36(30)80)46(60(90)77-50)74-61(91)47(28)73-59(89)35(20-43(69)82)72-62(49)92;/h6-11,13-19,23-24,34-35,42,44,46-54,56-57,65,71,78-81,83-87H,12,20-22,70H2,1-5H3,(H2,69,82)(H,72,92)(H,73,89)(H,74,91)(H,75,93)(H,76,88)(H,77,90)(H,94,95);1H/t24-,34+,35-,42+,44-,46+,47+,48-,49+,50-,51+,52+,53+,54-,56+,57+,65-,66-;/m0./s1
|
| chemicalCompound:standardIn... |
LCTORFDMHNKUSG-XTTLPDOESA-N
|
| chemicalCompound:canonicalS... |
Cl.CN[C@H](CC(C)C)C(=O)N[C@@H]1[C@H](O)c2ccc(Oc3cc4cc(Oc5ccc(cc5Cl)[C@@H](O)[C@@H]6NC(=O)[C@H](NC(=O)[C@@H]4NC(=O)[C@H](CC(=O)N)NC1=O)c7ccc(O)c(c7)c8c(O)cc(O)cc8[C@H](NC6=O)C(=O)O)c3O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O[C@H]%10C[C@](C)(N)[C@H](O)[C@H](C)O%10)c(Cl)c2
|
| chemicalCompound:molecularF... |
C66H76Cl3N9O24
|
| chemicalCompound:moleculeId |
674579
|
| chemicalCompound:mwFreebase |
1449.25
|
| chemicalCompound:fullMwt |
1485.71
|
| chemicalCompound:chemblId |
CHEMBL1200628
|
| chemicalCompound:maxPhase |
4
|
| chemicalCompound:therapeuti... |
1
|
| chemicalCompound:dosedIngre... |
Yes
|
| chemicalCompound:structureT... | |
| chemicalCompound:chebi | |
| chemicalCompound:moleculeTy... | |
| chemicalCompound:oral |
Yes
|
| chemicalCompound:parenteral |
Yes
|
| chemicalCompound:topical |
No
|
| chemicalCompound:blackBoxWa... |
No
|
| chemicalCompound:naturalPro... |
Yes
|
| chemicalCompound:proDrug |
No
|
| chemicalCompound:prefName |
VANCOMYCIN HYDROCHLORIDE
|
| chemicalCompound:activity |
activity:2302224,
activity:2303298,
activity:2303317,
activity:2303488,
activity:2303489,
activity:2303490,
activity:3491205,
activity:4069686,
activity:4182864,
activity:4444389,
activity:5748590,
activity:6787528,
activity:7445381,
activity:7855019,
activity:7855052,
activity:7855955,
activity:7855988,
activity:7856021,
activity:7856054,
activity:7856087,
activity:7856096,
activity:7856105,
activity:7856114,
activity:7856123,
activity:7856132,
activity:7856141,
activity:7856150
|