Concept information
Preferred term
برنینامایسین جی
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C51H53N15O15S
inchi
- InChI=1S/C51H53N15O15S/c1-13-32(68)50-66-36(27(12)81-50)47(78)57-22(7)42(73)63-33(18(2)3)45(76)59-24(9)49-65-35(26(11)80-49)46(77)56-21(6)41(72)58-23(8)48-61-30(16-79-48)37-28(51-62-31(17-82-51)44(75)64-34(25(10)67)39(53)70)14-15-29(60-37)43(74)55-20(5)40(71)54-19(4)38(52)69/h14-18,25,33-34,67H,4-9,13H2,1-3,10-12H3,(H2,52,69)(H2,53,70)(H,54,71)(H,55,74)(H,56,77)(H,57,78)(H,58,72)(H,59,76)(H,63,73)(H,64,75)/t25-,33+,34+/m1/s1
inchikey
- GEHAXWAIADEMGU-OCVOMCNHSA-N
mass
- 1148.140
monoisotopicmass
- 1147.35663
smiles
- S1C(=NC(=C1)C(=O)N[C@H](C(=O)N)[C@H](O)C)C2=C(N=C(C(=O)NC(C(=O)NC(C(=O)N)=C)=C)C=C2)C=3N=C(C(NC(=O)C(NC(=O)C=4N=C(C(NC(=O)[C@@H](NC(=O)C(NC(=O)C=5N=C(C(=O)CC)OC5C)=C)C(C)C)=C)OC4C)=C)=C)OC3
subset
- 2_STAR
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:221173
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