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N-(4-{[(8xi,9xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl]oxy}-4-oxobutanoyl)glutamic acid

Catalog ID
STL528094
SMILES O=C(NC(C(=O)O)CCC(=O)O)CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CCC1C2CCC2=CC(=O)CC[C@]12C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C30H41NO10 MW 575.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H41NO10/c1-28-12-9-18(32)15-17(28)3-4-19-20(28)10-13-29(2)21(19)11-14-30(29,40)23(33)16-41-26(37)8-6-24(34)31-22(27(38)39)5-7-25(35)36/h15,19-22,40H,3-14,16H2,1-2H3,(H,31,34)(H,35,36)(H,38,39)/t19?,20?,21?,22?,28-,29-,30-/m0/s1
InChIKey
RFYYZFMOXYYAOI-JESZGJGCSA-N
Synonyms

2((4(2((10~(R)13~(S)17~(R))17hydroxy1013dimethyl3oxo267891112141516decahydro1~(H)cyclopenta(a)phenanthren17yl)2oxoethoxy)4oxobutanoyl)amino)pentanedioicacid
2(4(2((8R9S10R13S14S17R)17hydroxy1013dimethyl3oxo2367891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren17yl)2oxoethoxy)4oxobutanamido)pentanedioicacid
44664968
InChI=1SC30H41NO10c12812918(32)1517(28)341920(28)101329(2)21(19)111430(2940)23(33)164126(37)8624(34)3122(27(38)39)5725(35)36h15192240H31416H212H3(H3134)(H3536)(H3839)t19?20?21?22?282930m0s1
MFCD03849959
N(4(((8xi9xi14xi)17hydroxy320dioxopregn4en21yl)oxy)4oxobutanoyl)glutamicacid
O=C(NC(C(=O)O)CCC(=O)O)CCC(=O)OCC(=O)(C@@)1(O)CC(C@@H)2(C@)1(C)CC(C@H)1(C@H)2CCC2=CC(=O)CC(C@)12C
ZINC000253501972
ZINC000253501983

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Available files

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