Search MNXref
 Feedback

DHCEO

PropertiesImage
MNX_IDMNXM28100 Image of MNXM28100
referencechebi:186771
formulaC27H44O3
global charge0
mol weight416.646
InChIKeyOGZFTYMLHGZVCH-GJQHYQARSA-N
InChIInChI=1S/C27H44O3/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24(29)27(30)16-19(28)11-14-26(27,5)23(20)12-13-25(21,22)4/h15,17-19,21-23,28,30H,6-14,16H2,1-5H3/t18-,19+,21+,22+,23+,25-,26-,27+/m1/s1
SMILESCC(C)CCC[C@@H](C)[C@@H]1CC[C@H]2C3=CC(=O)[C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C
MNX internals
InChI (mnx)InChI=1/C27H44O3/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24(29)27(30)16-19(28)11-14-26(27,5)23(20)12-13-25(21,22)4/h15,17-19,21-23,28,30H,6-14,16H2,1-5H3/t18-,19+,21+,22+,23+,25-,26-,27+/m1/s1 Image of MNXM28100
SMILES (mnx)[CH3:1][CH:17]([CH3:2])[CH2:7][CH2:6][CH2:8][C@@H:18]([CH3:3])[C@@H:21]1[CH2:9][CH2:10][C@H:22]2[C:20]3=[CH:15][C:24](=[O:29])[C@@:27]4([OH:30])[CH2:16][C@@H:19]([OH:28])[CH2:11][CH2:14][C@:26]4([CH3:5])[C@H:23]3[CH2:12][CH2:13][C@:25]12[CH3:4]
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:186771
chebi:186771
OGZFTYMLHGZVCH-GJQHYQARSA-N 		DHCEO
(3S,5R,9S,10R,13R,14R,17S)-3,5-dihydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one

lipidmaps:LMST01010260
lipidmapsM:LMST01010260
OGZFTYMLHGZVCH-GJQHYQARSA-N 		DHCEO
3beta,5alpha-dihydroxycholest-7-en-6-one
O3
ST 27:2