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chemical compound

AttributesValues
rdf:type
description
  • composto chimico (it)
  • химическое соединение (ru)
  • chemical compound (en)
  • composé chimique (fr)
  • תרכובת (he)
  • kemisk forbindelse (da)
  • compositum chemicum (la)
  • chemische Verbindung (de)
  • քիմիական միացություն (hy)
  • chemická sloučenina (cs)
  • chemická zlúčenina (sk)
  • chemische verbinding (nl)
  • kemia kombinaĵo (eo)
  • związek chemiczny (pl)
  • chemical compound (en-ca)
  • chemical compound (en-gb)
  • chemiese verbinding (af)
  • chemische Verbindung (de-ch)
  • component quimic (oc)
  • compost químic (ca)
  • composto químico (gl)
  • composto químico (pt)
  • composto químico (pt-br)
  • compuesto quimico (an)
  • compuestu químicu (ast)
  • compus chimic (ro)
  • kemiallinen yhdiste (fi)
  • kjemisk forbindelse (nb)
  • kjemisk sambinding (nn)
  • komponim kimik (sq)
  • konposatu kimiko (eu)
  • senyawa kimia (id)
  • ķīmisks savienojums (lv)
  • хімічна сполука (uk)
  • مركب كيميائي (ar)
  • রাসায়নিক যৌগ (bn)
  • compuesto químico (es)
  • payvastagii khimiyaviy (tg-latn)
  • пайвастагии химиявӣ (tg-cyrl)
  • chemesch Verbindung (lb)
rdfs:label
  • Atratumycin (en)
skos:prefLabel
  • Atratumycin (en)
name
  • Atratumycin (en)
isomeric SMILES
isomeric SMILES
  • Cc1ccccc1/C=C/C(=O)N[C@@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@H](CC(N)=O)C(=O)N[C@@H]([C@@H](O)c2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C(C)C)C(=O)NCC(=O)N[C@H](CC(C)C)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)O[C@@H]1C
instance of
instance of
subclass of
subclass of
found in taxon
found in taxon
UniChem compound ID
canonical SMILES
InChI
InChIKey
chemical formula
PubChem CID
PubChem CID
UniChem compound ID
  • 178086522
canonical SMILES
  • Cc1ccccc1C=CC(=O)NC1C(=O)NC(CO)C(=O)NC(Cc2c[nH]c3ccccc23)C(=O)NC(CC(N)=O)C(=O)NC(C(O)c2ccccc2)C(=O)N2CCCC2C(=O)NC(C(C)C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NC(Cc2ccc(O)cc2)C(=O)OC1C
InChI
  • InChI=1S/C68H84N12O16/c1-36(2)29-47-60(87)75-50(30-40-22-25-44(82)26-23-40)68(95)96-39(6)57(77-54(84)27-24-41-16-11-10-15-38(41)5)66(93)76-51(35-81)63(90)73-48(31-43-33-70-46-20-13-12-19-45(43)46)61(88)74-49(32-53(69)83)62(89)79-58(59(86)42-17-8-7-9-18-42)67(94)80-28-14-21-52(80)64(91)78-56(37(3)4)65(92)71-34-55(85)72-47/h7-13,15-20,22-27,33,36-37,39,47-52,56-59,70,81-82,86H,14,21,28-32,34-35H2,1-6H3,(H2,69,83)(H,71,92)(H,72,85)(H,73,90)(H,74,88)(H,75,87)(H,76,93)(H,77,84)(H,78,91)(H,79,89)/b27-24+/t39-,47-,48+,49-,50-,51+,52+,56-,57+,58+,59+/m1/s1
InChIKey
  • UFPVKIKINBECRQ-CNSCIBEJSA-N
chemical formula
  • C₆₈H₈₄N₁₂O₁₆
PubChem CID
  • 146683158
mass
mass
Natural Product Atlas ID
Natural Product Atlas ID
  • NPA026739
is about of
is main subject of
is main subject of
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