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CHEBI:211796 - Hymenosulfate

ChEBI IDCHEBI:211796
ChEBI NameHymenosulfate
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FormulaC29H48O4S
Net Charge0
Average Mass492.766
Monoisotopic Mass492.32733
SMILESC/C(=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](OS(=O)(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C)[C@H](C)C(C)C
InChIInChI=1S/C29H48O4S/c1-18(2)21(5)19(3)16-20(4)25-10-11-26-24-9-8-22-17-23(33-34(30,31)32)12-14-28(22,6)27(24)13-15-29(25,26)7/h8,16,18,20-21,23-27H,9-15,17H2,1-7H3,(H,30,31,32)/b19-16+/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1
InChIKeyJFPMYQBPAWZEIT-UCUGPCMVSA-N
ChEBI Ontology
Outgoing Relation(s)
Hymenosulfate (CHEBI:211796) has parent hydride gorgostane (CHEBI:24424)
Hymenosulfate (CHEBI:211796) is a steroid (CHEBI:35341)
IUPAC Name 
[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(E,2R,5R)-4,5,6-trimethylhept-3-en-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulate
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