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Namespace Prefixes
| Prefix | IRI |
|---|
| rdf | http://www.w3.org/1999/02/22-rdf-syntax-ns# |
| n3 | http://linked.opendata.cz/ontology/drugbank/ |
| n2 | http://linked.opendata.cz/resource/drugbank/property/ |
| xsdh | http://www.w3.org/2001/XMLSchema# |
Statements
- Subject Item
- n2:271B41CF-363D-11E5-9242-09173F13E4C5
- n3:propertySource
-
ChemAxon
ALOGPS
- n3:propertyValue
-
6
42.97
CC1=NC=C(COP(O)(O)=O)C(CN)=C1O
NCCCOP(O)(O)=O
6.59e-03 g/l
1
InChI=1S/C70H92ClN17O14/c1-39(2)31-52(61(94)82-51(15-9-28-77-69(73)74)68(101)88-30-10-16-58(88)67(100)79-40(3)59(72)92)83-60(93)50(14-8-29-78-70(75)102)81-63(96)54(34-43-20-25-49(91)26-21-43)86-66(99)57(38-89)87-65(98)56(36-45-11-7-27-76-37-45)85-64(97)55(33-42-18-23-48(71)24-19-42)84-62(95)53(80-41(4)90)35-44-17-22-46-12-5-6-13-47(46)32-44/h5-7,11-13,17-27,32,37,39-40,50-58,89,91H,8-10,14-16,28-31,33-36,38H2,1-4H3,(H2,72,92)(H,79,100)(H,80,90)(H,81,96)(H,82,94)(H,83,93)(H,84,95)(H,85,97)(H,86,99)(H,87,98)(H4,73,74,77)(H3,75,78,102)/t40-,50-,51+,52+,53-,54+,55-,56-,57+,58+/m1/s1
5.19
InChIKey=OOLLAFOLCSJHRE-ZHAKMVSLSA-N
-4.9
-2
104.06
-6.7
3.38e-01 g/l