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(25S)-3alpha-hydroxy-5alpha-cholest-7-en-26-oic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM149316

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₂₇H₄₄O₃

charge

mass

416.32905

reference

chebi:83149

InChIKey

WWAMLGNSINNDPI-NDGCQPAQSA-N

InChI

InChI=1S/C27H44O3/c1-17(6-5-7-18(2)25(29)30)22-10-11-23-21-9-8-19-16-20(28)12-14-26(19,3)24(21)13-15-27(22,23)4/h9,17-20,22-24,28H,5-8,10-16H2,1-4H3,(H,29,30)/t17-,18+,19+,20-,22-,23+,24+,26+,27-/m1/s1

SMILES

C[C@@H](CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C)C(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:83149 chebi:83149	(25S)-3alpha-hydroxy-5alpha-cholest-7-en-26-oic acid (+)-(25S)-3alpha-hydroxy-5alpha-cholest-7-en-26-oic acid (+)-3alpha-hydroxy-(5alpha,25S)-3-oxocholest-7-en-26-oic acid (3R,25S)-3-hydroxy-cholest-7-en-26-oic acid (3alpha,5alpha,25S)-3-hydroxy-7-cholestenoic acid (3alpha,5alpha,25S)-3-hydroxycholest-7-en-26-oic acid 3alpha-OH-Delta7()-dafachronic acid dafa#3 hyda#1
lipidmaps:LMST04030224 lipidmapsM:LMST04030224	3alpha-OH-Delta7-dafachronic acid (+)-3a-hydroxy-(5a,25S)-3-oxocholest-7-en-26-oic acid 25S)3alpha-hydroxy-5alpha-cholest-7-en-26-oic acid O3 ST 27:2 dafa#3