Vitas-M small molecule compound
spirost-5-en-3-yl hexanoate
Catalog ID
STL426029
SMILES CCCCCC(=O)OC1CCC2(C(=CCC3C2CCC2(C3CC3C2C(C)C2(O3)CCC(CO2)C)C)C1)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 C33H52O4 MW 512.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H52O4/c1-6-7-8-9-29(34)36-24-13-15-31(4)23(18-24)10-11-25-26(31)14-16-32(5)27(25)19-28-30(32)22(3)33(37-28)17-12-21(2)20-35-33/h10,21-22,24-28,30H,6-9,11-20H2,1-5H3InChIKey
VMOZFSWFUBLCNN-UHFFFAOYSA-NSynonyms
1260369-44-5(2R4S5R6aR6bS8aS8bR9S11aS12aS12bS)56a8a9tetramethyl133445566a6b6788a8b911a1212a12bicosahydrospiro(naphtho(2145)indeno(21b)furan102pyran)4ylhexanoate
1260369445
CCCCCC(=O)O(C@H)1CC(C@)2(C(=CC(C@@H)3(C@@H)2CC(C@)2((C@H)3C(C@H)3(C@@H)2(C@H)(C)(C@)2(O3)CC(C@H)(CO2)C)C)C1)C
CCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CC5C4C(C6(O5)CCC(CO6)C)C)C)C
InChI=1SC33H52O4c1678929(34)3624131531(4)23(1824)10112526(31)141632(5)27(25)192830(32)22(3)33(3728)171221(2)203533h102122242830H691120H215H3
MFCD30710327
spirost5en3ylhexanoate
ZINC000253527945
ZINC000253527951
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