Vitas-M small molecule compound
(8xi,9xi,14xi,17xi,19E)-19-(2-benzylhydrazinylidene)-3,5,14-trihydroxycard-20(22)-enolide
Catalog ID
STL524902
SMILES OC1CC[C@]2(C(C1)(O)CCC1C2CC[C@]2(C1(O)CCC2C1=CC(=O)OC1)C)/C=N/NCc1ccccc1
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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 C30H40N2O5 MW 508.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H40N2O5/c1-27-11-8-24-25(30(27,36)14-10-23(27)21-15-26(34)37-18-21)9-13-29(35)16-22(33)7-12-28(24,29)19-32-31-17-20-5-3-2-4-6-20/h2-6,15,19,22-25,31,33,35-36H,7-14,16-18H2,1H3/b32-19+/t22?,23?,24?,25?,27-,28+,29?,30?/m1/s1InChIKey
FYUXEMMUHOXKDQ-XFJMTORISA-NSynonyms
(8xi9xi14xi17xi19E)19(2benzylhydrazinylidene)3514trihydroxycard20(22)enolide
135638991
3((10~(R)13~(R))10((~(E))(benzylhydrazinylidene)methyl)3514trihydroxy13methyl23467891112151617dodecahydro1~(H)cyclopenta(a)phenanthren17yl)2~(H)furan5one
4((3S5S8R9S10R13R14S17R)10((E)(2benzylhydrazono)methyl)3514trihydroxy13methylhexadecahydro1Hcyclopenta(a)phenanthren17yl)furan2(5H)one
InChI=1SC30H40N2O5c1271182425(30(2736)141023(27)211526(34)371821)91329(35)1622(33)71228(2429)19323117205324620h261519222531333536H7141618H21H3b3219+t22?23?24?25?2728+29?30?m1s1
MFCD01546910
O(C@H)1CC(C@)2((C@)(C1)(O)CC(C@@H)1(C@@H)2CC(C@)2((C@)1(O)CC(C@@H)2C1=CC(=O)OC1)C)C=NNCc1ccccc1
ZINC001772491743
ZINC001772491746
Check stock
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Check stock on Vitas-MAvailable files
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