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(22E,24R)-ergosta-7,22-diene-3beta,5alpha,6beta,9alpha-tetrol

Properties

Image

Occurences in reactions

MNX_ID

MNXM109232

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

formula

C₂₈H₄₆O₄

charge

mass

446.33961

reference

chebi:68694

InChIKey

NYMHFYDQBMRBMB-IUMXJWHTSA-N

InChI

InChI=1S/C28H46O4/c1-17(2)18(3)7-8-19(4)21-9-10-22-23-15-24(30)28(32)16-20(29)11-12-26(28,6)27(23,31)14-13-25(21,22)5/h7-8,15,17-22,24,29-32H,9-14,16H2,1-6H3/b8-7+/t18-,19+,20-,21+,22-,24+,25+,26+,27+,28-/m0/s1

SMILES

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:68694 chebi:68694	(22E,24R)-ergosta-7,22-diene-3beta,5alpha,6beta,9alpha-tetrol (3beta,5alpha,6beta,22E)-ergosta-7,22-diene-3,5,6,9-tetrol 24alpha-methylcholesta-7,22E-diene-3beta,5alpha,6beta,9alpha-tetraol 9-hydroxycerevisterol
hmdb:HMDB0032123	(3beta,5alpha,6alpha,9alpha,22E,24R)-Ergosta-7,22-diene-3,5,6,9-tetrol (3b,5a,6a,9a,22E,24R)-Ergosta-7,22-diene-3,5,6,9-tetrol (3beta,5alpha,6alpha,9alpha,22E,24R)-ergosta-7,22-diene-3,5,6,9-tetrol 14-[(3E)-5,6-dimethylhept-3-en-2-yl]-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-9-ene-1,5,7,8-tetrol Quillaate 3-[galactosyl-(1->2)-[xylosyl-(1->3)]-glucuronide] 28-[apiosyl-(1->3)-xylosyl-(1->4)-rhamnosyl-(1->2)-[rhamnosyl-(1->3)]-4-acetyl-fucosyl] ester
hmdb:HMDB32123	secondary/obsolete/fantasy identifier