Search MNXref
 Feedback

poriferast-7-en-3beta-ol

PropertiesImage
MNX_IDMNXM81621 Image of MNXM81621
referencechebi:173016
formulaC29H50O
global charge0
mol weight414.718
InChIKeyYSKVBPGQYRAUQO-XCFYOIDPSA-N
InChIInChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h11,19-23,25-27,30H,7-10,12-18H2,1-6H3/t20-,21+,22+,23+,25-,26+,27+,28+,29-/m1/s1
SMILESCC[C@@H](CC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
MNX internals
InChI (mnx)InChI=1/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h11,19-23,25-27,30H,7-10,12-18H2,1-6H3/t20-,21+,22+,23+,25-,26+,27+,28+,29-/m1/s1 Image of MNXM81621
SMILES (mnx)[CH3:1][CH2:7][C@@H:21]([CH2:9][CH2:8][C@@H:20]([CH3:4])[C@H:25]1[CH2:12][CH2:13][C@H:26]2[C:24]3=[CH:11][CH2:10][C@H:22]4[CH2:18][C@@H:23]([OH:30])[CH2:14][CH2:16][C@:28]4([CH3:5])[C@H:27]3[CH2:15][CH2:17][C@:29]12[CH3:6])[CH:19]([CH3:2])[CH3:3]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:173016
chebi:173016
YSKVBPGQYRAUQO-XCFYOIDPSA-N 		poriferast-7-en-3beta-ol
(3S,5S,9R,10S,13R,14R,17R)-17-[(2R,5S)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

metacyc.compound:CPD-14901
metacycM:CPD-14901
seed.compound:cpd32096
seedM:cpd32096
YSKVBPGQYRAUQO-XCFYOIDPSA-N 		22-dihydrochondrillasterol
24beta-ethylcholest-7-en-3beta-ol
chondrillast-7-enol
dihydrochondrillasterol
poriferst-7-enol

lipidmaps:LMST01040125
lipidmapsM:LMST01040125
YSKVBPGQYRAUQO-XCFYOIDPSA-N 		poriferast-7-en-3beta-ol
O
ST 29:1

seedM:M_cpd32096 		secondary/obsolete/fantasy identifier