Vitas-M small molecule compound
(3E,5xi,9xi,13xi,17xi,18xi)-3-(hydroxyimino)lup-20(29)-en-28-yl acetate
Catalog ID
STL526209
SMILES O/N=C/1\CC[C@]2(C(C1(C)C)CC[C@@]1(C2CCC2[C@@]1(C)CCC1(C2[C@@H](CC1)C(=C)C)COC(=O)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 C32H51NO3 MW 497.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H51NO3/c1-20(2)22-11-16-32(19-36-21(3)34)18-17-30(7)23(27(22)32)9-10-25-29(6)14-13-26(33-35)28(4,5)24(29)12-15-31(25,30)8/h22-25,27,35H,1,9-19H2,2-8H3/b33-26+/t22-,23?,24?,25?,27?,29-,30+,31+,32?/m0/s1InChIKey
XYULXMLIRWBOTK-QWUMFZGWSA-NSynonyms
((1~(R)5~(a)~(R)5~(b)~(R)9~(E)11~(a)~(R))9hydroxyimino5~(a)5~(b)8811~(a)pentamethyl1prop1en2yl2345677~(a)101111~(b)121313~(a)13~(b)tetradecahydro1~(H)cyclopenta(a)chrysen3~(a)yl)methylacetate
((1R3aS5aR5bR11aR11bR13aRE)9(hydroxyimino)5a5b8811apentamethyl1(prop1en2yl)icosahydro1Hcyclopenta(a)chrysen3ayl)methylacetate
(3E5xi9xi13xi17xi18xi)3(hydroxyimino)lup20(29)en28ylacetate
44667691
InChI=1SC32H51NO3c120(2)22111632(193621(3)34)181730(7)23(27(22)32)9102529(6)141326(3335)28(45)24(29)121531(2530)8h22252735H1919H228H3b3326+t2223?24?25?27?2930+31+32?m0s1
MFCD02058401
ON=C1CC(C@)2(C(C1(C)C)CC(C@@)1((C@@H)2CC(C@H)2(C@@)1(C)CC(C@@)1(C2(C@@H)(CC1)C(=C)C)COC(=O)C)C)C
ZINC000012876311
ZINC000012876329
Check stock
See real-time availability and sample size for STL526209 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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