Ergost-2-en-26-oic acid, 6,7-epoxy-5,14,20,22-tetrahydroxy-1-oxo-, δ-lactone, (5α,6α,7α,22R,25R)-
CAS Registry Number®
107221-65-8
CAS Name
Ergost-2-en-26-oic acid, 6,7-epoxy-5,14,20,22-tetrahydroxy-1-oxo-, δ-lactone, (5α,6α,7α,22R,25R)-Molecular Formula
C28H40O7Molecular Mass
488.61Cite this Page
Ergost-2-en-26-oic acid, 6,7-epoxy-5,14,20,22-tetrahydroxy-1-oxo-, δ-lactone, (5α,6α,7α,22R,25R)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=107221-65-8 (retrieved ) (CAS RN: 107221-65-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C28H40O7/c1-14-13-19(34-23(30)15(14)2)26(5,31)17-9-12-27(32)20-16(8-11-24(17,27)3)25(4)18(29)7-6-10-28(25,33)22-21(20)35-22/h6-7,14-17,19-22,31-33H,8-13H2,1-5H3/t14-,15+,16-,17-,19+,20-,21-,22-,24+,25-,26+,27+,28-/m0/s1
InChIKey
InChIKey=SPZVPSAUINZULS-YQGHBCRRSA-N
SMILES
O[C@]12[C@@]3([C@]4([C@](O4)([C@]5(O)[C@@](C)([C@]3(CC[C@]1(C)[C@@]([C@@](C)(O)[C@]6(C[C@H](C)[C@@H](C)C(=O)O6)[H])(CC2)[H])[H])C(=O)C=CC5)[H])[H])[H]
Canonical SMILES
O=C1OC(CC(C)C1C)C(O)(C)C2CCC3(O)C4C5OC5C6(O)CC=CC(=O)C6(C)C4CCC23C
Other Names for this Substance
- Ergost-2-en-26-oic acid, 6,7-epoxy-5,14,20,22-tetrahydroxy-1-oxo-, δ-lactone, (5α,6α,7α,22R,25R)-
- 6,7-Epoxy-1H-cyclopenta[a]phenanthrene, ergost-2-en-26-oic acid deriv.