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(8xi,9xi,14xi)-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl 4-[(4-methoxybenzyl)amino]-4-oxobutanoate

Catalog ID
STL537262
SMILES COc1ccc(cc1)CNC(=O)CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CC(O)C1C2CCC2=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 C33H43NO8 MW 581.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H43NO8/c1-31-14-12-22(35)16-21(31)6-9-24-25-13-15-33(40,32(25,2)17-26(36)30(24)31)27(37)19-42-29(39)11-10-28(38)34-18-20-4-7-23(41-3)8-5-20/h4-5,7-8,16,24-26,30,36,40H,6,9-15,17-19H2,1-3H3,(H,34,38)/t24?,25?,26?,30?,31-,32-,33-/m0/s1
InChIKey
CIMLWONNDDFZSY-WPYIPTSUSA-N
Synonyms

(2((10~(R)13~(S)17~(R))1117dihydroxy1013dimethyl3oxo267891112141516decahydro1~(H)cyclopenta(a)phenanthren17yl)2oxoethyl)4((4methoxyphenyl)methylamino)4oxobutanoate
(8xi9xi14xi)1117dihydroxy320dioxopregn4en21yl4((4methoxybenzyl)amino)4oxobutanoate
16406096
2((10R13S17R)1117dihydroxy1013dimethyl3oxo2367891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren17yl)2oxoethyl4((4methoxybenzyl)amino)4oxobutanoate
COc1ccc(cc1)CNC(=O)CCC(=O)OCC(=O)(C@@)1(O)CCC2(C@)1(C)CC(O)C1C2CCC2=CC(=O)CC(C@)12C
InChI=1SC33H43NO8c131141222(35)1621(31)692425131533(4032(252)1726(36)30(24)31)27(37)194229(39)111028(38)3418204723(413)8520h4578162426303640H69151719H213H3(H3438)t24?25?26?30?313233m0s1
MFCD05733674
ZINC000070706869
ZINC000253498978

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Available files

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