Concept information
Preferred term
هکتوکلرین
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C27H34Cl2N2O9S2
inchi
- InChI=1S/C27H34Cl2N2O9S2/c1-13-17(9-8-10-27(7,28)29)38-23(34)15-11-42-21(30-15)19(37-14(2)32)26(5,6)40-24(35)16-12-41-20(31-16)18(25(3,4)36)39-22(13)33/h11-13,17-19,36H,8-10H2,1-7H3/t13-,17-,18+,19+/m0/s1
inchikey
- USXIYWCPCGVOKF-NOENWEJRSA-N
mass
- 665.590
monoisotopicmass
- 664.10828
smiles
- ClC(Cl)(CCC[C@@H]1OC(=O)C=2N=C([C@@H](OC(=O)C)C(OC(C=3N=C([C@@H](OC([C@H]1C)=O)C(O)(C)C)SC3)=O)(C)C)SC2)C
subset
- 2_STAR
synonym EXACT
- [(5S,12S,13S,16S)-12-(4,4-dichloropentyl)-16-(2-hydroxypropan-2-yl)-4,4,13-trimethyl-2,10,14-trioxo-3,11,15-trioxa-7,18-dithia-20,21-diazatricyclo[15.2.1.16,9]henicosa-1(19),6(21),8,17(20)-tetraen-5-yl] acetate
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:217551
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