Concept information
Preferred term
استرپتوباکتین
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C51H69N15O18
has_role
inchi
- InChI=1S/C51H69N15O18/c1-22-34(64-43(76)28(13-7-19-58-49(52)53)61-40(73)25-10-4-16-31(67)37(25)70)46(79)83-24(3)36(66-45(78)30(15-9-21-60-51(56)57)63-42(75)27-12-6-18-33(69)39(27)72)48(81)84-23(2)35(47(80)82-22)65-44(77)29(14-8-20-59-50(54)55)62-41(74)26-11-5-17-32(68)38(26)71/h4-6,10-12,16-18,22-24,28-30,34-36,67-72H,7-9,13-15,19-21H2,1-3H3,(H,61,73)(H,62,74)(H,63,75)(H,64,76)(H,65,77)(H,66,78)(H4,52,53,58)(H4,54,55,59)(H4,56,57,60)/t22-,23-,24-,28+,29+,30+,34+,35+,36+/m1/s1
inchikey
- WLSGYSOOUFLHHA-XKCQZYHGSA-N
mass
- 1180.18330
monoisotopicmass
- 1179.49450
smiles
- C[C@H]1OC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c2cccc(O)c2O)[C@@H](C)OC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)c2cccc(O)c2O)[C@@H](C)OC(=O)[C@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)c1cccc(O)c1O
subset
- 2_STAR
synonym RELATED
- Benzamide, N,N',N''-[[(2R,3S,6R,7S,10R,11S)-2,6,10-trimethyl-4,8,12-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl]tris[imino[(1S)-1-[3-[(aminoiminomethyl)amino]propyl]-2-oxo-2,1-ethanediyl]]]tris[2,3- dihydroxy-
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:68885
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