Vitas-M small molecule compound
(5xi,9xi,13xi,17xi,18xi)-3-oxolup-20(29)-en-28-yl acetate
Catalog ID
STL564684
SMILES CC(=O)OCC12CC[C@H](C2C2[C@](CC1)(C)[C@]1(C)CCC3[C@](C1CC2)(C)CCC(=O)C3(C)C)C(=C)C
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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 C32H50O3 MW 482.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H50O3/c1-20(2)22-11-16-32(19-35-21(3)33)18-17-30(7)23(27(22)32)9-10-25-29(6)14-13-26(34)28(4,5)24(29)12-15-31(25,30)8/h22-25,27H,1,9-19H2,2-8H3/t22-,23?,24?,25?,27?,29-,30+,31+,32?/m0/s1InChIKey
KONAXQKGWYDUTG-BDHUSWEWSA-NSynonyms
((1R3aS5aR5bR11aR11bR13aR)5a5b8811apentamethyl9oxo1(prop1en2yl)icosahydro1Hcyclopenta(a)chrysen3ayl)methylacetate
((1R5aR5bR11aR)5a5b8811apentamethyl9oxo1prop1en2yl2345677a101111b121313a13btetradecahydro1Hcyclopenta(a)chrysen3ayl)methylacetate
(5xi9xi13xi17xi18xi)3oxolup20(29)en28ylacetate
3OXOLUP20(29)EN28YLACETATE
46397496
CC(=O)OC(C@@)12CC(C@H)(C2(C@@H)2(C@)(CC1)(C)(C@)1(C)CCC3(C@)((C@H)1CC2)(C)CCC(=O)C3(C)C)C(=C)C
InChI=1SC32H50O3c120(2)22111632(193521(3)33)181730(7)23(27(22)32)9102529(6)141326(34)28(45)24(29)121531(2530)8h222527H1919H228H3t2223?24?25?27?2930+31+32?m0s1
ZINC000008951829
ZINC000008951833
Check stock
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Check stock on Vitas-MAvailable files
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