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CHEBI:22934 - bufanolide

ChEBI IDCHEBI:22934
ChEBI Namebufanolide
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Last Modified17 February 2020
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FormulaC24H38O2
Net Charge0
Average Mass358.566
Monoisotopic Mass358.28718
SMILES[H][C@]1([C@@]2([H])CC[C@]3([H])[C@]4([H])CCC5CCCC[C@]5(C)[C@@]4([H])CC[C@]23C)CCC(=O)OC1
InChIInChI=1S/C24H38O2/c1-23-13-4-3-5-17(23)7-8-18-20-10-9-19(16-6-11-22(25)26-15-16)24(20,2)14-12-21(18)23/h16-21H,3-15H2,1-2H3/t16-,17?,18-,19+,20+,21-,23-,24+/m0/s1
InChIKeyPXOHOSHERMSUCD-YQMMVUDVSA-N
ChEBI Ontology
Outgoing Relation(s)
bufanolide (CHEBI:22934) is a steroid fundamental parent (CHEBI:35508)
bufanolide (CHEBI:22934) is a steroid lactone (CHEBI:26766)
Incoming Relation(s)
(2β,3β,5β)-2,3-diacetoxy-5,14-dihydroxy-19-oxobufa-20,22-dienolide (CHEBI:229934) has functional parent bufanolide (CHEBI:22934)
5-(3,14-Dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pyran-2-one (CHEBI:181100) has functional parent bufanolide (CHEBI:22934)
5-[14-hydroxy-10,13-dimethyl-3-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-pyranone (CHEBI:95358) has functional parent bufanolide (CHEBI:22934)
5beta-hydroxybufotalin (CHEBI:229791) has functional parent bufanolide (CHEBI:22934)
Arenobufagin (CHEBI:197067) has functional parent bufanolide (CHEBI:22934)
Bryophyllin A (CHEBI:3199) has functional parent bufanolide (CHEBI:22934)
bryotoxin A (CHEBI:3201) has functional parent bufanolide (CHEBI:22934)
bufalin (CHEBI:517248) has functional parent bufanolide (CHEBI:22934)
bufogenin (CHEBI:31319) has functional parent bufanolide (CHEBI:22934)
Bufotalin (CHEBI:80799) has functional parent bufanolide (CHEBI:22934)
Bufotalin 3-succinoylarginine ester (CHEBI:229072) has functional parent bufanolide (CHEBI:22934)
Cinobufagin (CHEBI:80805) has functional parent bufanolide (CHEBI:22934)
Cinobufotalin (CHEBI:80806) has functional parent bufanolide (CHEBI:22934)
Gamabufogenin (CHEBI:80826) has functional parent bufanolide (CHEBI:22934)
Glucoscilliroside (CHEBI:169535) has functional parent bufanolide (CHEBI:22934)
Hellebrigenin 3-acetate (CHEBI:5644) has functional parent bufanolide (CHEBI:22934)
Hellebrigenin glucoside (CHEBI:182734) has functional parent bufanolide (CHEBI:22934)
Lanceotoxin A (CHEBI:6371) has functional parent bufanolide (CHEBI:22934)
Lanceotoxin B (CHEBI:6372) has functional parent bufanolide (CHEBI:22934)
meproscillarin (CHEBI:135824) has functional parent bufanolide (CHEBI:22934)
resibufagenin (CHEBI:146183) has functional parent bufanolide (CHEBI:22934)
scillarenin (CHEBI:38248) has functional parent bufanolide (CHEBI:22934)
Scillipheosidin 3-[glucosyl-(1->2)-rhamnoside] (CHEBI:190727) has functional parent bufanolide (CHEBI:22934)
scillirosidin (CHEBI:37417) has functional parent bufanolide (CHEBI:22934)
Telocinobufagin (CHEBI:80908) has functional parent bufanolide (CHEBI:22934)
5α-bufanolide (CHEBI:35540) is a bufanolide (CHEBI:22934)
5β-bufanolide (CHEBI:20661) is a bufanolide (CHEBI:22934)
IUPAC Name 
bufanolide