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(23S,24S)-17,23-Epoxy-24,29-dihydroxy-27-norlanost-8-ene-3,15-dione

PropertiesImage
MNX_IDMNXM114947 Image of MNXM114947
referencechebi:168013
formulaC29H44O5
global charge0
mol weight472.666
InChIKeyIPZHIWYVRSTEKX-UHFFFAOYSA-N
InChIInChI=1S/C29H44O5/c1-7-20(31)21-14-17(2)29(34-21)15-24(33)28(6)19-8-9-22-25(3,18(19)10-13-27(28,29)5)12-11-23(32)26(22,4)16-30/h17,20-22,30-31H,7-16H2,1-6H3
SMILESCCC(O)C1CC(C)C2(CC(=O)C3(C)C4=C(CCC32C)C2(C)CCC(=O)C(C)(CO)C2CC4)O1
MNX internals
InChI (mnx)InChI=1/C29H44O5/c1-7-20(31)21-14-17(2)29(34-21)15-24(33)28(6)19-8-9-22-25(3,18(19)10-13-27(28,29)5)12-11-23(32)26(22,4)16-30/h17,20-22,30-31H,7-16H2,1-6H3/t17?,20?,21?,22?,25?,26?,27?,28?,29? Image of MNXM114947
SMILES (mnx)[CH3:1][CH2:7][CH:20]([CH:21]1[CH2:14][CH:17]([CH3:2])[C:29]2([CH2:15][C:24](=[O:33])[C:28]3([CH3:6])[C:19]4=[C:18]([CH2:10][CH2:13][C:27]32[CH3:5])[C:25]2([CH3:3])[CH2:12][CH2:11][C:23](=[O:32])[C:26]([CH3:4])([CH2:16][OH:30])[CH:22]2[CH2:9][CH2:8]4)[O:34]1)[OH:31]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:168013
chebi:168013
IPZHIWYVRSTEKX-UHFFFAOYSA-N 		(23S,24S)-17,23-Epoxy-24,29-dihydroxy-27-norlanost-8-ene-3,15-dione
4-(hydroxymethyl)-5'-(1-hydroxypropyl)-3',4,10,13,14-pentamethylspiro[1,2,5,6,7,11,12,16-octahydrocyclopenta[a]phenanthrene-17,2'-oxolane]-3,15-dione
hmdb:HMDB0035843
IPZHIWYVRSTEKX-UHFFFAOYSA-N 		(23S,24S)-17,23-Epoxy-24,29-dihydroxy-27-norlanost-8-ene-3,15-dione
6'-(hydroxymethyl)-5-(1-hydroxypropyl)-2',3,6',11',15'-pentamethylspiro[oxolane-2,14'-tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan]-1'(10')-ene-5',12'-dione

hmdb:HMDB35843 		secondary/obsolete/fantasy identifier