| Predicate | Object |
|---|---|
| rdf:type | |
| chemicalCompound:synonym | |
| chemicalCompound:standardIn... |
InChI=1S/C68H107N23O19S2/c1-5-35(3)52-63(107)85-44(27-38-18-11-8-12-19-38)59(103)82-41(21-14-24-77-67(72)73)56(100)89-48(65(109)110)34-112-111-33-47(88-61(105)46(32-93)87-54(98)39(69)31-92)62(106)84-43(26-37-16-9-7-10-17-37)55(99)80-29-49(94)79-30-50(95)81-40(20-13-23-76-66(70)71)57(101)90-53(36(4)6-2)64(108)86-45(28-51(96)97)60(104)83-42(58(102)91-52)22-15-25-78-68(74)75/h7-12,16-19,35-36,39-48,52-53,92-93H,5-6,13-15,20-34,69H2,1-4H3,(H,79,94)(H,80,99)(H,81,95)(H,82,103)(H,83,104)(H,84,106)(H,85,107)(H,86,108)(H,87,98)(H,88,105)(H,89,100)(H,90,101)(H,91,102)(H,96,97)(H,109,110)(H4,70,71,76)(H4,72,73,77)(H4,74,75,78)/t35-,36-,39+,40+,41+,42-,43+,44-,45+,46+,47+,48+,52+,53-/m0/s1
|
| chemicalCompound:standardIn... |
NRDMYPVKHYERIZ-CORSIEQUSA-N
|
| chemicalCompound:canonicalS... |
CC[C@H](C)[C@H]1NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](CCCN=C(N)N)NC(=O)CNC(=O)CNC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](CSSC[C@@H](NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](Cc3ccccc3)NC1=O)C(=O)O)NC(=O)[C@@H](CO)NC(=O)[C@H](N)CO)[C@@H](C)CC
|
| chemicalCompound:molecularF... |
C68 H107 N23 O19 S2
|
| chemicalCompound:moleculeId |
278480
|
| chemicalCompound:mwFreebase |
1614.85
|
| chemicalCompound:fullMwt |
1614.85
|
| chemicalCompound:chemblId |
CHEMBL436967
|
| chemicalCompound:maxPhase |
0
|
| chemicalCompound:therapeuti... |
0
|
| chemicalCompound:dosedIngre... |
No
|
| chemicalCompound:structureT... | |
| chemicalCompound:chebi | |
| chemicalCompound:moleculeTy... | |
| chemicalCompound:oral |
No
|
| chemicalCompound:parenteral |
No
|
| chemicalCompound:topical |
No
|
| chemicalCompound:blackBoxWa... |
No
|
| chemicalCompound:naturalPro... |
No
|
| chemicalCompound:proDrug |
No
|
| chemicalCompound:activity |