Vitas-M small molecule compound

3-hydroxy-29-(morpholin-4-yl)olean-12-ene-11,29-dione

Catalog ID
STK996232
SMILES O=C1C=C2C3CC(C)(CCC3(C)CCC2(C2(C1C1(C)CCC(C(C1CC2)(C)C)O)C)C)C(=O)N1CCOCC1

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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 C34H53NO4 MW 539.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H53NO4/c1-29(2)25-8-11-34(7)27(32(25,5)10-9-26(29)37)24(36)20-22-23-21-31(4,28(38)35-16-18-39-19-17-35)13-12-30(23,3)14-15-33(22,34)6/h20,23,25-27,37H,8-19,21H2,1-7H3
InChIKey
SJUQBTKRFGXBGO-UHFFFAOYSA-N
Synonyms

10hydroxy24a6a6b9912aheptamethyl2(morpholine4carbonyl)34566a788a10111214bdodecahydro1Hpicen13one
3hydroxy29(morpholin4yl)olean12ene1129dione
CC1(C2CCC3(C(C2(CCC1O)C)C(=O)C=C4C3(CCC5(C4CC(CC5)(C)C(=O)N6CCOCC6)C)C)C)C
InChI=1SC34H53NO4c129(2)2581134(7)27(32(255)10926(29)37)24(36)2022232131(428(38)35161839191735)131230(233)141533(2234)6h2023252737H81921H217H3
MFCD02031311
ZINC000245297267
ZINC000245297274

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Available files

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