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methyl (5S,6R,7R,14Z)-5,6,7,12-tetrakis(acetyloxy)-10-chloro-9-oxoprosta-10,14-dien-1-oate

Properties

Image

Occurences in reactions

MNX_ID

MNXM33310

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

formula

C₂₉H₄₁ClO₁₁

charge

mass

600.23374

reference

chebi:73758

InChIKey

QCXWMBWSNWERAP-OSOZVZRNSA-N

InChI

InChI=1S/C29H41ClO11/c1-7-8-9-10-11-12-16-29(41-21(5)34)17-22(30)26(36)25(29)28(40-20(4)33)27(39-19(3)32)23(38-18(2)31)14-13-15-24(35)37-6/h11-12,17,23,25,27-28H,7-10,13-16H2,1-6H3/b12-11-/t23-,25+,27+,28+,29+/m0/s1

SMILES

CCCCC/C=C\C[C@@]1(OC(C)=O)C=C(Cl)C(=O)[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](CCCC(=O)OC)OC(C)=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:73758 chebi:73758	methyl (5S,6R,7R,14Z)-5,6,7,12-tetrakis(acetyloxy)-10-chloro-9-oxoprosta-10,14-dien-1-oate 12S-acetoxy-punaglandin 2 methyl (5S,6R,14Z)-5,6,7,12-tetrakis(acetyloxy)-10-chloro-9-oxoprosta-10,14-dien-1-oate
lipidmaps:LMFA03120030 lipidmapsM:LMFA03120030	12S-acetoxy-punaglandin 2 methyl 5S,6R,7R,12S-tetraacetoxy-9-oxo-10-chloro-10Z,14Z-prostadienoate-cyclo[8R,12S]