Concept information
Preferred term
N [(3R,9R,10R) 12 [(2R) 1 hydroxypropan 2 yl] 3,10 dimethyl 9 (methylaminomethyl) 13 oxo 2,8 dioxa 12 azabicyclo[12.4.0]octadeca 1(14)، 15،17 سولفونتیل تری ان 4، 15،17 سولفونتیل تری ان 4
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C29H43N3O7S
inchi
- InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28+/m1/s1
inchikey
- MPJVZFHLUPPQBG-KUMFRPPMSA-N
mass
- 577.735
monoisotopicmass
- 577.28217
smiles
- C[C@@H]1CCCCO[C@H]([C@@H](CN(C(=O)C2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)OC)[C@H](C)CO)C)CNC
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:123785
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