(Q27126132)

AC1NP928 (English)

6 October 2016

C₂₄H₄₁O₇S⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC(CCCOS(=O)(=O)[O-])C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C

1 reference

AC1NP928 (English)

6 October 2016

C[C@H](CCCOS(=O)(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C

1 reference

InChI=1S/C24H42O7S/c1-14(5-4-10-31-32(28,29)30)17-6-7-18-22-19(13-21(27)24(17,18)3)23(2)9-8-16(25)11-15(23)12-20(22)26/h14-22,25-27H,4-13H2,1-3H3,(H,28,29,30)/p-1/t14-,15-,16-,17-,18+,19+,20-,21+,22+,23+,24-/m1/s1

AC1NP928 (English)

retrieved

6 October 2016

Identifiers

InChI

1 reference

BKZKSSHAWFCVDU-JLIFGLSWSA-M

AC1NP928 (English)

6 October 2016

2 references

AC1NP928 (English)

6 October 2016

ChEBI release 2020-09-01

1 reference

(3alpha,5alpha,7alpha,8xi,12alpha)-3,7,12-Trihydroxycholan-24-yl sulfate (English)

6 October 2016

1 reference

AC1NP928 (English)

retrieved

6 October 2016

Reaxys registry number

11197773

1 reference

3alpha,7alpha,12alpha-trihydroxy-5alpha-cholan-24-yl sulfate(1-) (English)

retrieved

6 October 2016

ChEBI ID

58809

mapping relation type

1 reference