Vitas-M small molecule compound
(5alpha,8xi,9xi,14xi,16xi,17xi,20xi)-28-acetylspirosolan-3-yl acetate
Catalog ID
STL526240
SMILES CC1CCC2(N(C1)C(=O)C)OC1C(C2C)[C@@]2(C(C1)C1CC[C@@H]3[C@](C1CC2)(C)CCC(C3)OC(=O)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 C31H49NO4 MW 499.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H49NO4/c1-18-9-14-31(32(17-18)20(3)33)19(2)28-27(36-31)16-26-24-8-7-22-15-23(35-21(4)34)10-12-29(22,5)25(24)11-13-30(26,28)6/h18-19,22-28H,7-17H2,1-6H3/t18?,19?,22-,23?,24?,25?,26?,27?,28?,29-,30-,31?/m0/s1InChIKey
XBYGONLLFUVZNC-RBPLJWTDSA-NSynonyms
((9~(S)13~(S)18~(S))1acetyl57913tetramethylspiro(5oxapentacyclo(10800^(29)0^(48)0^(1318))icosane62piperidine)16yl)acetate
(2aS2R4S5R6aS6bS8aS8bR9S11aS12aS12bR)1acetyl56a8a9tetramethyloctadecahydrospiro(naphtho(2145)indeno(21b)furan102piperidin)4ylacetate
(5alpha8xi9xi14xi16xi17xi20xi)28acetylspirosolan3ylacetate
135639144
C(C@@H)1CC(C@@)2(N(C1)C(=O)C)O(C@@H)1(C@H)((C@@H)2C)(C@@)2((C@@H)(C1)(C@@H)1CC(C@@H)3(C@)((C@H)1CC2)(C)CC(C@@H)(C3)OC(=O)C)C
InChI=1SC31H49NO4c11891431(32(1718)20(3)33)19(2)2827(3631)16262487221523(3521(4)34)101229(225)25(24)111330(2628)6h18192228H717H216H3t18?19?2223?24?25?26?27?28?293031?m0s1
MFCD02925694
ZINC001772492110
ZINC001772492113
Check stock
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Check stock on Vitas-MAvailable files
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