MetaADEDB 2.0 @ LMMD
Teichomycin A2-3
(BJNLLBUOHPVGFT-VPMXZCLFSA-N)
Structure
SMILES
CCCCCCCCCC(=O)N[C@H]1[C@@H](O[C@@H]([C@H]([C@@H]1O)O)CO)Oc1c2cc3cc1Oc1ccc(cc1Cl)C[C@@H]1C(=O)N[C@H](C(=O)N[C@H]3C(=O)N[C@H]3C(=O)N[C@@H]([C@@H](c4ccc(O2)c(Cl)c4)O[C@@H]2O[C@H](CO)[C@H]([C@@H]([C@H]2NC(=O)C)O)O)C(=O)N[C@H](c2c(c4cc3ccc4O)c(cc(c2)O)O[C@H]2O[C@H](CO)[C@H]([C@@H]([C@@H]2O)O)O)C(=O)O)c2cc(O)cc(c2)Oc2cc([C@@H](C(=O)N1)N)ccc2O
Molecular Formula:
C88H97Cl2N9O33
Molecular Weight:
1879.660
Log P:
4.6185
Hydrogen Bond Acceptor:
42
Hydrogen Bond Donor:
24
TPSA:
662.41
CAS Number(s):
61036-62-2
Synonym(s)
1.
Teichomycin A2-3
2.
(1S,2R,19R,22S,34S,37R,40R,52R)-2-[(2R,3R,4R,5S,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-22-azaniumyl-5,15-dichloro-64-[(2S,3R,4R,5S,6R)-3-(decanoylamino)-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-26,31,44,49-tetrahydroxy-21,35,38,54,56,59-hexaoxo-47-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,13,28-trioxa-20,36,39,53,55,58-hexazaundecacyclo[38.14.2.23,6.214,17.219,34.18,12.123,27.129,33.141,45.010,37.046,51]hexahexaconta-3,5,8,10,12(64),14,16,23(61),24,26,29(60),30,32,41(57),42,44,46(51),47,49,62,65-henicosaene-52-carboxylate
External Link(s)
PubChem Compound16134398
16129701
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1AbscessSIDER
2AgranulocytosisSIDER
3Anaphylactic shockSIDER
4AngioedemaSIDER
5BronchospasmSIDER
6ChillsSIDER
7DeafnessSIDER
8DermatitisSIDER
9DizzinessSIDER
10EosinophiliaSIDER
11Erythema MultiformeSIDER
12ErythemaSIDER
13FlushingSIDER
14HeadacheSIDER
15HypersensitivitySIDER
16LeukopeniaSIDER
17Local reactionSIDER
18NauseaSIDER
19NeutropeniaSIDER
20PainSIDER
21PhlebitisSIDER
22PruritusSIDER
23RednessSIDER
24Stevens-Johnson SyndromeSIDER
25ThrombocytopeniaSIDER
26ThrombophlebitisSIDER
27TinnitusSIDER
28Toxic Epidermal NecrolysisSIDER
29Transaminases increasedSIDER
30UrticariaSIDER
31VertigoSIDER
32VomitingSIDER
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