(3β)-Lup-20(29)-ene-3,27-diol
CAS Registry Number®
58940-21-9
CAS Name
(3β)-Lup-20(29)-ene-3,27-diolMolecular Formula
C30H50O2Molecular Mass
442.72Cite this Page
(3β)-Lup-20(29)-ene-3,27-diol. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=58940-21-9 (retrieved ) (CAS RN: 58940-21-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C30H50O2/c1-19(2)20-10-13-27(5)16-17-30(18-31)21(25(20)27)8-9-23-28(6)14-12-24(32)26(3,4)22(28)11-15-29(23,30)7/h20-25,31-32H,1,8-18H2,2-7H3/t20-,21+,22-,23+,24-,25+,27+,28-,29+,30-/m0/s1
InChIKey
InChIKey=XHOGEOQSRLNKKB-MSBRALANSA-N
SMILES
C(O)[C@]12[C@@]3(C)[C@@]([C@]4(C)[C@@](CC3)(C(C)(C)[C@@H](O)CC4)[H])(CC[C@@]1([C@@]5([C@@](C)(CC2)CC[C@H]5C(C)=C)[H])[H])[H]
Canonical SMILES
OCC12CCC3(C)CCC(C(=C)C)C3C2CCC4C5(C)CCC(O)C(C)(C)C5CCC41C
Other Names for this Substance
- Lup-20(29)-ene-3,27-diol, (3β)-
- (3β)-Lup-20(29)-ene-3,27-diol
- Lup-20(29)-ene-3β,27-diol