Concept information
Preferred term
irinotecan (1+)
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- +1
formula
- C33H39N4O6
inchi
- InChI=1S/C33H38N4O6/c1-3-22-23-16-21(43-32(40)36-14-10-20(11-15-36)35-12-6-5-7-13-35)8-9-27(23)34-29-24(22)18-37-28(29)17-26-25(30(37)38)19-42-31(39)33(26,41)4-2/h8-9,16-17,20,41H,3-7,10-15,18-19H2,1-2H3/p+1/t33-/m0/s1
inchikey
- UWKQSNNFCGGAFS-XIFFEERXSA-O
is_conjugate_acid_of
mass
- 587.687
monoisotopicmass
- 587.28641
smiles
- C1(=CC=C2C(=C1)C(=C3C(=N2)C=4N(C3)C(C5=C(C4)[C@](C(OC5)=O)(CC)O)=O)CC)OC(=O)N6CCC(CC6)[NH+]7CCCCC7
subset
- 3_STAR
synonym EXACT
- 1-[1-({[(4S)-4,11-diethyl-4-hydroxy-3,14-dioxo-3,4,12,14-tetrahydro-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinolin-9-yl]oxy}carbonyl)piperidin-4-yl]piperidin-1-ium
synonym RELATED
- irinotecan cation
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:90895
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