Vitas-M small molecule compound
(5xi,9xi,13xi,17xi,18xi,28E)-28-(hydroxyimino)lup-20(29)-en-3-yl acetate
Catalog ID
STL540137
SMILES O/N=C/C12CC[C@H](C2C2[C@](CC1)(C)[C@]1(C)CCC3[C@](C1CC2)(C)CCC(C3(C)C)OC(=O)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 C32H51NO3 MW 497.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H51NO3/c1-20(2)22-11-16-32(19-33-35)18-17-30(7)23(27(22)32)9-10-25-29(6)14-13-26(36-21(3)34)28(4,5)24(29)12-15-31(25,30)8/h19,22-27,35H,1,9-18H2,2-8H3/b33-19+/t22-,23?,24?,25?,26?,27?,29-,30+,31+,32?/m0/s1InChIKey
OSJWUPILPXIQLP-UADNECNRSA-NSynonyms
((1~(R)5~(a)~(R)5~(b)~(R)11~(a)~(R))3~(a)((~(E))hydroxyiminomethyl)5~(a)5~(b)8811~(a)pentamethyl1prop1en2yl12345677~(a)9101111~(b)121313~(a)13~(b)hexadecahydrocyclopenta(a)chrysen9yl)acetate
(1R5aR5bR11aR)3a((E)(hydroxyimino)methyl)5a5b8811apentamethyl1(prop1en2yl)icosahydro1Hcyclopenta(a)chrysen9ylacetate
(5xi9xi13xi17xi18xi28E)28(hydroxyimino)lup20(29)en3ylacetate
42648544
InChI=1SC32H51NO3c120(2)22111632(193335)181730(7)23(27(22)32)9102529(6)141326(3621(3)34)28(45)24(29)121531(2530)8h19222735H1918H228H3b3319+t2223?24?25?26?27?2930+31+32?m0s1
MFCD02057198
ON=CC12CC(C@H)(C2C2(C@)(CC1)(C)(C@)1(C)CCC3(C@)(C1CC2)(C)CCC(C3(C)C)OC(=O)C)C(=C)C
ZINC000253530646
ZINC000253530652
Check stock
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Check stock on Vitas-MAvailable files
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