Concept information
Preferred term
3 هیدروکسی N متیلولویتیندولینون C ایزوتیوسیانات
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C22H21ClN2O3S
inchi
- InChI=1S/C22H21ClN2O3S/c1-6-20(4)15(23)10-13-17(26)21(20,24-11-29)12-8-7-9-14-16(12)22(28,19(13,2)3)18(27)25(14)5/h6-10,13,28H,1H2,2-5H3/t13-,20+,21+,22-/m0/s1
inchikey
- VDNAFECSPBXWIH-WOHBTAIZSA-N
mass
- 428.930
monoisotopicmass
- 428.09614
smiles
- ClC1=C[C@H]2C(=O)[C@]([C@@]1(C=C)C)(N=C=S)C3=C4C(=CC=C3)N(C([C@@]4(C2(C)C)O)=O)C
subset
- 2_STAR
synonym EXACT
- (2S,3S,6R,8S)-4-chloro-3-ethenyl-8-hydroxy-2-isothiocyanato-3,7,7,10-tetramethyl-10-azatetracyclo[6.6.1.12,6.011,15]hexadeca-1(15),4,11,13-tetraene-9,16-dione
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:216445
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