lupan-3β,20-diol

Chemical Formula:

C₃₀H₅₂O₂

Molecular Weight:

444.74 Daltons

Monoisotopic Mass:

444.3967309134 Daltons

SMILES:

CC1(C)(C(CCC5([CH]1CCC4(C)([CH](CC[CH]3([CH]2(C(C)(CC[CH](C(C)(C)O)2)CCC(C)34)))5))(C))O)

InChI:

1S/C30H52O2/c1-25(2)21-12-16-30(8)22(28(21,6)15-13-23(25)31)10-9-20-24-19(26(3,4)32)11-14-27(24,5)17-18-29(20,30)7/h19-24,31-32H,9-18H2,1-8H3/t19-,20-,21+,22-,23+,24-,27-,28+,29-,30-/m1/s1

InChIKey:

YDNYDUBBAZTLTQ-LIVJDELJSA-N

Synonyms

3,20-dihydroxylupane

Databases

MetaCyc: CPD-6951

ChemSpider: 8179187

ChEBI: 62735

KEGG: C19863

PubChem (CID): 10003607

Seed: cpd21104

MetaNetX: MNXM5814