Vitas-M small molecule compound
(9xi,10xi,13xi,22alpha)-spirosol-5-en-3-ol
Catalog ID
STK053430
SMILES CC1CC[C@@]2(NC1)O[C@@H]1[C@H]([C@@H]2C)C2([C@@H](C1)[C@@H]1CC=C3C(C1CC2)(C)CCC(C3)O)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 C27H43NO2 MW 413.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H43NO2/c1-16-7-12-27(28-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(29)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28-29H,6-15H2,1-4H3/t16?,17-,19?,20+,21?,22-,23-,24-,25?,26?,27+/m0/s1InChIKey
KWVISVAMQJWJSZ-VAHNFGKOSA-NSynonyms
(3BETA9XI22ALPHA25R)SPIROSOL5EN3OL
(9XI10XI13XI22ALPHA)SPIROSOL5EN3OL
CC1CC(C@@)2(NC1)O(C@@H)1(C@H)((C@@H)2C)C2((C@@H)(C1)(C@@H)1CC=C3C(C1CC2)(C)CCC(C3)O)C
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)O)C)C)C)NC1
InChI=1SC27H43NO2c11671227(281516)17(2)2423(3027)14222065181319(29)81025(183)21(20)91126(2224)4h5161719242829H615H214H3t16?1719?20+21?22232425?26?27+m0s1
MFCD00778451
STK053430
ZINC000008214722
ZINC000118917292
ZINC000253498059
Check stock
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Check stock on Vitas-MAvailable files
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