Einecs 242-826-6
group of stereoisomers with the chemical formula C₄₅H₇₃NO₁₆
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Einecs 242-826-6
Summary
Einecs 242-826-6 is a group of stereoisomers[1].
Key Facts
- Einecs 242-826-6's instance of is recorded as group of stereoisomers[2].
- Einecs 242-826-6's canonical SMILES is recorded as OCC1OC(OC2C(O)C(OC(OC3CC4=CCC5C(CCC6(C)C5CC7OC8(NCC(C)CC8)C(C)C76)C4(C)CC3)C2OC9OC(C)C(O)C(O)C9O)CO)C(O)C(O)C1O[3].
- Einecs 242-826-6's InChI is recorded as InChI=1S/C45H73NO16/c1-19-8-13-45(46-16-19)20(2)30-27(62-45)15-26-24-7-6-22-14-23(9-11-43(22,4)25(24)10-12-44(26,30)5)57-42-39(61-40-36(54)34(52)31(49)21(3)56-40)38(33(51)29(18-48)59-42)60-41-37(55)35(53)32(50)28(17-47)58-41/h6,19-21,23-42,46-55H,7-18H2,1-5H3/t19-,20+,21+,23+,24-,25?,26?,27?,28-,29-,30?,31+,32-,33+,34-,35+,36-,37-,38+,39-,40+,41+,42-,43+,44+,45-/m1/s1[4].
- Einecs 242-826-6's InChIKey is recorded as QCTMYNGDIBTNSK-QEXRXOOOSA-N[5].
- Einecs 242-826-6's chemical formula is recorded as C₄₅H₇₃NO₁₆[6].
- Einecs 242-826-6's subclass of is recorded as Q105218573[7].
- Einecs 242-826-6's PubChem CID is recorded as 118701087[8].
- Einecs 242-826-6's isomeric SMILES is recorded as C[C@@H]1OC@@HC@HC@H[C@H]1OC@@HC@@HC@@HO[C@H]2O[C@H]2CC[C@@]3(C)C(=CC[C@H]4C5CC6O[C@]7(CCC@@HCN7)">[9].
- Einecs 242-826-6's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+883.492935256'}[10].
- Einecs 242-826-6's UniChem compound ID is recorded as 145245261[11].