Concept information
Preferred term
مایکوباکتین جی
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C45H71N5O9
inchi
- InChI=1S/C45H71N5O9/c1-5-7-8-9-10-11-12-13-14-15-16-17-21-30-39(51)49(56)31-24-23-29-37(47-42(53)40-34(4)58-43(48-40)35-26-19-18-20-27-35)45(55)59-38(6-2)33(3)41(52)46-36-28-22-25-32-50(57)44(36)54/h18-21,26-27,30,33-34,36-38,40,56-57H,5-17,22-25,28-29,31-32H2,1-4H3,(H,46,52)(H,47,53)/b30-21-/t33-,34+,36-,37-,38+,40-/m0/s1
inchikey
- WWLHPLBUIBTYIH-LIPSAQSSSA-N
mass
- 826.089
monoisotopicmass
- 825.52518
smiles
- O=C1N(O)CCCC[C@@H]1NC(=O)[C@H]([C@H](OC(=O)[C@@H](NC(=O)[C@H]2N=C(C3=CC=CC=C3)O[C@@H]2C)CCCCN(O)C(=O)/C=C/CCCCCCCCCCCCC)CC)C
subset
- 2_STAR
synonym EXACT
- [(2S,3R)-1-[[(3S)-1-hydroxy-2-oxoazepan-3-yl]amino]-2-methyl-1-oxopentan-3-yl] (2S)-6-[[(Z)-hexadec-2-enoyl]-hydroxyamino]-2-[[(4S,5R)-5-methyl-2-phenyl-4,5-dihydro-1,3-oxazole-4-carbonyl]amino]hexanoate
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:205364
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