Vitas-M small molecule compound
(8xi,9xi,14xi,16xi,17xi)-spirost-5-en-3-yl benzoate
Catalog ID
STL524634
SMILES CC1CC[C@@]2(OC1)OC1C([C@@H]2C)[C@@]2(C(C1)C1CC=C3[C@](C1CC2)(C)CCC(C3)OC(=O)c1ccccc1)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 C34H46O4 MW 518.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H46O4/c1-21-12-17-34(36-20-21)22(2)30-29(38-34)19-28-26-11-10-24-18-25(37-31(35)23-8-6-5-7-9-23)13-15-32(24,3)27(26)14-16-33(28,30)4/h5-10,21-22,25-30H,11-20H2,1-4H3/t21?,22-,25?,26?,27?,28?,29?,30?,32-,33-,34+/m0/s1InChIKey
CWUJEAGCIAAOMQ-HGYDNWDTSA-NSynonyms
((6~(R)7~(S)9~(S)13~(R))57913tetramethylspiro(5oxapentacyclo(10800^(29)0^(48)0^(1318))icos18ene62oxane)16yl)benzoate
(2R6aR8aS9S)56a8a9tetramethyl133445566a6b6788a8b911a1212a12bicosahydrospiro(naphtho(2145)indeno(21b)furan102pyran)4ylbenzoate
(8xi9xi14xi16xi17xi)spirost5en3ylbenzoate
16396510
CC1CC(C@@)2(OC1)OC1C((C@@H)2C)(C@@)2(C(C1)C1CC=C3(C@)(C1CC2)(C)CCC(C3)OC(=O)c1ccccc1)C
InChI=1SC34H46O4c121121734(362021)22(2)3029(3834)1928261110241825(3731(35)238657923)131532(243)27(26)141633(2830)4h51021222530H1120H214H3t21?2225?26?27?28?29?30?323334+m0s1
MFCD01881368
ZINC000253499113
ZINC000253499164
Check stock
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Check stock on Vitas-MAvailable files
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