Ursan-28-oic acid, 3,13-dihydroxy-, γ-lactone, (3β)-
CAS Registry Number®
29428-70-4
CAS Name
Ursan-28-oic acid, 3,13-dihydroxy-, γ-lactone, (3β)-Molecular Formula
C30H48O3Molecular Mass
456.70Cite this Page
Ursan-28-oic acid, 3,13-dihydroxy-, γ-lactone, (3β)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=29428-70-4 (retrieved ) (CAS RN: 29428-70-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C30H48O3/c1-18-8-14-29-17-16-28(7)27(6)13-9-20-25(3,4)22(31)11-12-26(20,5)21(27)10-15-30(28,33-24(29)32)23(29)19(18)2/h18-23,31H,8-17H2,1-7H3/t18-,19+,20+,21-,22+,23-,26+,27-,28+,29+,30+/m1/s1
InChIKey
InChIKey=JGZVNQDYYGVIBP-RUOWOPRNSA-N
SMILES
C[C@]12[C@@]3([C@]4([C@@](C(=O)O3)(CC1)CC[C@@H](C)[C@@H]4C)[H])CC[C@]5([C@@]2(C)CC[C@@]6([C@]5(C)CC[C@H](O)C6(C)C)[H])[H]
Canonical SMILES
O=C1OC23CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CCC16CCC(C)C(C)C62
Other Names for this Substance
- Ursan-28-oic acid, 3,13-dihydroxy-, γ-lactone, (3β)-
- 19αH-Ursan-28-oic acid, 3β,13-dihydroxy-, γ-lactone
- Urs-11-ene 13β(28)-olide