Concept information
Preferred term
(12R) 15 آمینو 13 (/{2 [(4 کربوکسی 1 هیدروکسی بوتیلیدین) ] [( متیل) C کربونیمیدول] اتیل/} سولفانیل) 3،7،12 تری ،،6،8،،16 ( هگزا متیلول1، ،،،،،) ، oxoheptadec انوئیک اسید
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C37H61N5O12S2
inchi
- InChI=1S/C37H61N5O12S2/c1-19(32(49)21(3)33(50)36(5,6)27(43)15-30(45)46)9-8-12-37(7,54)28(14-25(39)20(2)13-23-17-55-22(4)41-23)56-18-26(34(51)40-16-31(47)48)42-29(44)11-10-24(38)35(52)53/h13,17,19,21,24-28,32,43,49,54H,8-12,14-16,18,38-39H2,1-7H3,(H,40,51)(H,42,44)(H,45,46)(H,47,48)(H,52,53)/b20-13+/t19?,21?,24?,25?,26?,27?,28?,32?,37-/m1/s1
inchikey
- APTRESWJFASOON-NHSXWKRCSA-N
mass
- 832.040
monoisotopicmass
- 831.37581
smiles
- NC(CC([C@](CCCC(C(C(C(C(C(CC(=O)O)O)(C)C)=O)C)O)C)(C)O)SCC(/C(=N/CC(=O)O)/O)/N=C(/CCC(C(=O)O)N)/O)/C(=C/C1=CSC(=N1)C)/C
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:194059
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