γ-chaconine

Chemical Formula:

C₃₃H₅₄NO₆

Molecular Weight:

560.793 Daltons

Monoisotopic Mass:

560.3951134712 Daltons

SMILES:

CC7(C[N+]3(C(C(C2(C1(CCC4(C)(C5(CCC(CC(=CCC(C1CC23)4)5)OC6(OC(C(C(C6O)O)O)O))C))C))C)CC7))

InChI:

1S/C33H53NO6/c1-17-6-9-23-18(2)25-24(34(23)16-17)15-22-21-8-7-19-14-20(39-30-28(37)26(35)27(36)29(38)40-30)10-11-32(19,4)33(21,5)13-12-31(22,25)3/h7,17-18,20-30,35-38H,6,8-16H2,1-5H3/p+1/t17-,18+,20?,21-,22-,23+,24-,25-,26-,27-,28+,29-,30+,31-,32-,33-/m0/s1

InChIKey:

POQFUAVGKLMRNZ-KMWQNQBRSA-O

Synonyms

beta-D-Glucopyranoside, (3beta)-solanid-5-en-3-yl

Databases

MetaCyc: CPD-9216

PubChem (CID): 25200462

Seed: cpd25609

HMDB: HMDB33678

MetaNetX: MNXM164596