(2S,4aR,5R,6aR,7R,8aR,9S,10S,11S,14R,14aS,16aS,18aS,18bR)-6,6a,10,11,14,14a,17,18,18a,18b-Decahydro-5,16a-dihydroxy-10,14a,18b-trimethyl-2H-7,11-(epoxymethano)-2,4a-etheno-7,9:10,14-dimethano-7H-[1,2]dioxino[4,3-h]oxocino[3′,4′:2,3]furo[3,4-c][2]benzoxocin-1,12,16,22(5H,9H,16aH)-tetrone
CAS Registry Number®
76045-35-7
CAS Name
(2S,4aR,5R,6aR,7R,8aR,9S,10S,11S,14R,14aS,16aS,18aS,18bR)-6,6a,10,11,14,14a,17,18,18a,18b-Decahydro-5,16a-dihydroxy-10,14a,18b-trimethyl-2H-7,11-(epoxymethano)-2,4a-etheno-7,9:10,14-dimethano-7H-[1,2]dioxino[4,3-h]oxocino[3′,4′:2,3]furo[3,4-c][2]benzoxocin-1,12,16,22(5H,9H,16aH)-tetroneMolecular Formula
C28H30O12Molecular Mass
558.53Cite this Page
(2S,4aR,5R,6aR,7R,8aR,9S,10S,11S,14R,14aS,16aS,18aS,18bR)-6,6a,10,11,14,14a,17,18,18a,18b-Decahydro-5,16a-dihydroxy-10,14a,18b-trimethyl-2H-7,11-(epoxymethano)-2,4a-etheno-7,9:10,14-dimethano-7H-[1,2]dioxino[4,3-h]oxocino[3′,4′:2,3]furo[3,4-c][2]benzoxocin-1,12,16,22(5H,9H,16aH)-tetrone. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=76045-35-7 (retrieved ) (CAS RN: 76045-35-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C28H30O12/c1-22-9-16-24(3)28-17(22)19(31)27(39-28,35-10-13(22)20(32)36-16)12-8-15(29)26-7-5-14(38-40-26)18(30)23(26,2)11(12)4-6-25(28,34)21(33)37-24/h5,7,11-17,29,34H,4,6,8-10H2,1-3H3
InChIKey
InChIKey=IRYOOASWRCIZCK-UHFFFAOYSA-N
SMILES
CC12C34C5C6(C)C(C(=O)OC1C6)COC(O3)(C5=O)C7C(CCC4(O)C(=O)O2)C8(C)C9(C(O)C7)C=CC(C8=O)OO9
Canonical SMILES
O=C1OC2CC3(C)C1COC45OC6(C3C4=O)C(O)(C(=O)OC26C)CCC7C5CC(O)C89OOC(C=C8)C(=O)C79C
Other Names for this Substance
- 2H-7,11-(Epoxymethano)-2,4a-etheno-7,9:10,14-dimethano-7H-[1,2]dioxino[4,3-h]oxocino[3′,4′:2,3]furo[3,4-c][2]benzoxocin-1,12,16,22(5H,9H,16aH)-tetrone, 6,6a,10,11,14,14a,17,18,18a,18b-decahydro-5,16a-dihydroxy-10,14a,18b-trimethyl-, (2S,4aR,5R,6aR,7R,8aR,9S,10S,11S,14R,14aS,16aS,18aS,18bR)-
- 16,24-Cyclo-13,14-secoergost-3-ene-18,26-dioic acid, 2,5-epidioxy-14,17:14,27-diepoxy-6,13,20,22-tetrahydroxy-1,15-dioxo-, γ-lactone δ-lactone, (2α,5α,6β,14α,16β,22α,25S)-
- (2S,4aR,5R,6aR,7R,8aR,9S,10S,11S,14R,14aS,16aS,18aS,18bR)-6,6a,10,11,14,14a,17,18,18a,18b-Decahydro-5,16a-dihydroxy-10,14a,18b-trimethyl-2H-7,11-(epoxymethano)-2,4a-etheno-7,9:10,14-dimethano-7H-[1,2]dioxino[4,3-h]oxocino[3′,4′:2,3]furo[3,4-c][2]benzoxocin-1,12,16,22(5H,9H,16aH)-tetrone
- Physalin K
- 2H-7,11-(Epoxymethano)-2,4a-etheno-7,9:10,14-dimethano-7H-[1,2]dioxino[4,3-h]oxocino[3′,4′:2,3]furo[3,4-c][2]benzoxocin-1,12,16,22(5H,9H,16aH)-tetrone, 6,6a,10,11,14,14a,17,18,18a,18b-decahydro-5,16a-dihydroxy-10,14a,18b-trimethyl-, [2S-(2α,4aα,5α,6aα,7β,8aS*,9β,10α,11β,14α,14aβ,16aβ,18aβ,18bα)]-