Q104251015
group of stereoisomers with the chemical formula C₄₅H₇₄O₁₇
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Q104251015
Summary
Q104251015 is a group of stereoisomers[1].
Key Facts
- Q104251015's instance of is recorded as group of stereoisomers[2].
- Q104251015's canonical SMILES is recorded as O=C1CC2C3CCC(C(C)C4OC(OC5OC(C)C(O)C(O)C5O)C(C)CC4)C3(C)CCC2C6(C)CCC(OC7OC(CO)C(O)C(O)C7OC8OC(C)C(O)C(O)C8O)CC16[3].
- Q104251015's InChI is recorded as InChI=1S/C45H74O17/c1-18-7-10-29(59-40(18)62-42-38(55)35(52)32(49)21(4)57-42)19(2)24-8-9-25-23-16-28(47)27-15-22(11-13-45(27,6)26(23)12-14-44(24,25)5)58-43-39(36(53)33(50)30(17-46)60-43)61-41-37(54)34(51)31(48)20(3)56-41/h18-27,29-43,46,48-55H,7-17H2,1-6H3/t18-,19+,20+,21+,22+,23?,24?,25+,26+,27-,29?,30-,31+,32+,33-,34-,35-,36+,37-,38-,39-,40-,41+,42+,43-,44-,45-/m1/s1[4].
- Q104251015's InChIKey is recorded as QZOALWMSYRBZSA-MCHLEXFWSA-N[5].
- Q104251015's chemical formula is recorded as C₄₅H₇₄O₁₇[6].
- Q104251015's subclass of is recorded as cholestane steroid[7].
- Q104251015's PubChem CID is recorded as 118701246[8].
- Q104251015's isomeric SMILES is recorded as CC@HC1CC[C@H]2C3CC(=O)[C@H]4CC@@HCC[C@]4(C)[C@H]3CC[C@]12CC@HC1CC[C@H]2C3CC(=O)[C@H]4C[C@@H](O[C@@H]5OC@HC@@HC@H[C@H]5O[C@@H]5O[C@@H](">[9].
- Q104251015's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+886.4926009080001'}[10].
- Q104251015's UniChem compound ID is recorded as 145245420[11].