4,7-Didehydroneophysalin B

CAS Registry Number®

134461-76-0

CAS Name

4,7-Didehydroneophysalin B

Molecular Formula

C28H28O9

Molecular Mass

508.52

Cite this Page

4,7-Didehydroneophysalin B.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=134461-76-0 (retrieved 2024-11-13) (CAS RN: 134461-76-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C28H28O9/c1-23-11-18-25(3)28-20(23)27(22(32)37-28,34-12-16(23)19(30)35-18)15-8-7-13-5-4-6-17(29)24(13,2)14(15)9-10-26(28,33)21(31)36-25/h4-8,14-16,18,20,33H,9-12H2,1-3H3/t14-,15+,16-,18+,20+,23+,24-,25-,26-,27-,28-/m0/s1

InChIKey

InChIKey=KUSIVZBQAMNZCO-MVBDKYCCSA-N

SMILES

C[C@]12[C@]34[C@]5([C@](C(=O)O3)([C@]6([C@](CC[C@]4(O)C(=O)O1)([C@]7(C)C(C=C6)=CC=CC7=O)[H])[H])OC[C@@]8([C@@]5(C)C[C@]2(OC8=O)[H])[H])[H]

Canonical SMILES

O=C1OC2CC3(C)C1COC45C(=O)OC6(C43)C(O)(C(=O)OC26C)CCC7C5C=CC8=CC=CC(=O)C87C

Other Names for this Substance

  • 13H-16,6a-(Epoxymethano)-15,2,16-(methanoxymetheno)-4H,6aH-naphtho[1′,2′:7,8]cycloocta[1,2-b]pyrano[4,3-d]pyran-4,12,19,21(12aH)-tetrone, 1,2,4a,5,6b,12b,14,15,16a,16b-decahydro-15-hydroxy-12a,16b,17-trimethyl-, (2R,4aS,6aS,6bR,12aR,12bS,15R,16R,16aS,16bS,17S)-
  • 13H-16,6a-(Epoxymethano)-15,2,16-(methanoxymetheno)-4H,6aH-naphtho[1′,2′:7,8]cycloocta[1,2-b]pyrano[4,3-d]pyran-4,12,19,21(12aH)-tetrone, 1,2,4a,5,6b,12b,14,15,16a,16b-decahydro-15-hydroxy-12a,16b,17-trimethyl-, [2R-(2α,4aα,6aβ,6bα,12aα,12bβ,15β,16β,16aα,16bβ,17S*)]-
  • (2R,4aS,6aS,6bR,12aR,12bS,15R,16R,16aS,16bS,17S)-1,2,4a,5,6b,12b,14,15,16a,16b-Decahydro-15-hydroxy-12a,16b,17-trimethyl-13H-16,6a-(epoxymethano)-15,2,16-(methanoxymetheno)-4H,6aH-naphtho[1′,2′:7,8]cycloocta[1,2-b]pyrano[4,3-d]pyran-4,12,19,21(12aH)-tetrone
  • 4,7-Didehydroneophysalin B

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles