cholesteryl-β-D-glucoside

Chemical Formula:

C₃₃H₅₆O₆

Molecular Weight:

548.802 Daltons

Monoisotopic Mass:

548.4076895302001 Daltons

SMILES:

CC(C)CCCC(C)[CH]1(CC[CH]2(C(C)1CC[CH]3([CH]2CC=C5(C(C)3CCC(OC4(OC(CO)C(O)C(O)C(O)4))C5))))

InChI:

1S/C33H56O6/c1-19(2)7-6-8-20(3)24-11-12-25-23-10-9-21-17-22(13-15-32(21,4)26(23)14-16-33(24,25)5)38-31-30(37)29(36)28(35)27(18-34)39-31/h9,19-20,22-31,34-37H,6-8,10-18H2,1-5H3/t20-,22+,23+,24-,25+,26+,27-,28-,29+,30-,31-,32+,33-/m1/s1

InChIKey:

FSMCJUNYLQOAIM-UQBZCTSOSA-N

Synonyms

O-β-D-glucosyl-cholesterol
cholesterol β-D-glucoside
(3β)-cholest-5-en-3-yl-β-D-glucopyranoside

Databases

MetaCyc: CPD-556

PubChem (CID): 440145

ChemSpider: 20015887

ChEBI: 17495

KEGG: C03855

RefMet: Cholesteryl beta-D-glucoside

Seed: cpd02405

MetaNetX: MNXM3945