chemical compound

AttributesValues
rdf:type
description
  • химическое соединение (ru)
  • chemical compound (en)
  • composé chimique (fr)
  • compositum chemicum (la)
  • chemische Verbindung (de)
  • chemische verbinding (nl)
  • compuestu químicu (ast)
  • хімічна сполука (uk)
  • রাসায়নিক যৌগ (bn)
rdfs:label
  • (2S,3S,8R,9R,10R,13R,14R,16S,17R)-17-[(E,2S)-2,6-dihydroxy-6-methyl-3-oxohept-4-en-2-yl]-2,3,16-trihydroxy-4,4,9,13,14-pentamethyl-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-11-one (en)
skos:prefLabel
  • (2S,3S,8R,9R,10R,13R,14R,16S,17R)-17-[(E,2S)-2,6-dihydroxy-6-methyl-3-oxohept-4-en-2-yl]-2,3,16-trihydroxy-4,4,9,13,14-pentamethyl-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-11-one (en)
name
  • (2S,3S,8R,9R,10R,13R,14R,16S,17R)-17-[(E,2S)-2,6-dihydroxy-6-methyl-3-oxohept-4-en-2-yl]-2,3,16-trihydroxy-4,4,9,13,14-pentamethyl-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-11-one (en)
isomeric SMILES
stereoisomer of
isomeric SMILES
  • CC(C)(O)/C=C/C(=O)[C@@](C)(O)[C@H]1[C@@H](O)C[C@]2(C)[C@H]3CC=C4[C@@H](C[C@H](O)[C@@H](O)C4(C)C)[C@]3(C)C(=O)C[C@]12C
stereoisomer of
instance of
instance of
subclass of
subclass of
found in taxon
found in taxon
canonical SMILES
InChI
InChIKey
chemical formula
PubChem CID
PubChem CID
canonical SMILES
  • O=C(C=CC(O)(C)C)C(O)(C)C1C(O)CC2(C)C3CC=C4C(CC(O)C(O)C4(C)C)C3(C(=O)CC12C)C
InChI
  • InChI=1S/C30H46O7/c1-25(2,36)12-11-21(33)30(8,37)23-19(32)14-27(5)20-10-9-16-17(13-18(31)24(35)26(16,3)4)29(20,7)22(34)15-28(23,27)6/h9,11-12,17-20,23-24,31-32,35-37H,10,13-15H2,1-8H3/b12-11+/t17-,18+,19+,20-,23+,24-,27-,28-,29+,30-/m1/s1
InChIKey
  • AOHIGMQGPFTKQX-WTJZVSAKSA-N
chemical formula
  • C₃₀H₄₆O₇
PubChem CID
  • 163189628
mass
mass
is about of
is stereoisomer of of
is stereoisomer of of
is main subject of
is main subject of
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