contignasterol
group of stereoisomers
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contignasterol
Summary
contignasterol is a group of stereoisomers[1].
Key Facts
- contignasterol's instance of is recorded as group of stereoisomers[2].
- contignasterol's canonical SMILES is recorded as CC(C)C1CC(OC(C1)O)C(C)C2CC(=O)C3C2(CCC4C3C(C(C5C4(CCC(C5O)O)C)O)O)C[3].
- contignasterol's InChI is recorded as InChI=1S/C29H48O7/c1-13(2)15-10-20(36-21(32)11-15)14(3)17-12-19(31)23-22-16(6-8-29(17,23)5)28(4)9-7-18(30)25(33)24(28)27(35)26(22)34/h13-18,20-27,30,32-35H,6-12H2,1-5H3/t14?,15-,16?,17+,18?,20?,21?,22+,23+,24?,25-,26+,27?,28+,29+/m0/s1[4].
- contignasterol's InChIKey is recorded as IRHVLQMEQPABHG-YVDIUZAXSA-N[5].
- contignasterol's chemical formula is recorded as C₂₉H₄₈O₇[6].
- contignasterol's subclass of is recorded as stigmastan-type steroid[7].
- contignasterol's ChemSpider ID is recorded as 331982[8].
- contignasterol's PubChem CID is recorded as 374202[9].
- contignasterol's isomeric SMILES is recorded as CC(C)[C@H]1CC(OC(C1)O)C(C)[C@H]2CC(=O)[C@H]3[C@@]2(CCC4[C@H]3C@HO)CC@HO)C">[10].
- contignasterol's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+508.340004'}[11].
- contignasterol's UniChem compound ID is recorded as 27210965[12].