25,27-Dihydro-4,7-didehydro-7-deoxyneophysalin A

CAS Registry Number®

134434-71-2
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CAS Name

25,27-Dihydro-4,7-didehydro-7-deoxyneophysalin A

Molecular Formula

C28H30O9

Molecular Mass

510.53

Cite this Page

25,27-Dihydro-4,7-didehydro-7-deoxyneophysalin A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=134434-71-2 (retrieved 2024-09-20) (CAS RN: 134434-71-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C28H30O9/c1-13-19(30)35-18-12-23(13,2)20-27(34)16-9-8-14-6-5-7-17(29)24(14,3)15(16)10-11-26(33)21(31)36-25(18,4)28(20,26)37-22(27)32/h5-9,13,15-16,18,20,33-34H,10-12H2,1-4H3/t13-,15+,16-,18-,20-,23-,24+,25+,26+,27+,28+/m1/s1

InChIKey

InChIKey=NSFHPMKDYVTYOY-LNWXSGTISA-N

SMILES

C[C@]12[C@]34[C@@]([C@](O)(C(=O)O3)[C@]5([C@](CC[C@]4(O)C(=O)O1)([C@]6(C)C(C=C5)=CC=CC6=O)[H])[H])([C@]7(C)C[C@]2(OC(=O)[C@H]7C)[H])[H]

Canonical SMILES

O=C1OC2CC(C)(C1C)C3C4(O)C(=O)OC35C(O)(C(=O)OC25C)CCC6C4C=CC7=CC=CC(=O)C76C

Other Names for this Substance

  • 14b,7-(Epoxymethano)-8,12-methano-1H,14bH-11,13-dioxacyclopenta[fg]naphth[2,1-b]octalene-1,10,14,18(6aH,14aH)-tetrone, 7,7a,8,9,12,12a,15,16,16a,16b-decahydro-7,14a-dihydroxy-8,9,12a,16b-tetramethyl-, (6aR,7S,7aR,8S,9S,12R,12aS,14aR,14bR,16aS,16bR)-
  • 14b,7-(Epoxymethano)-8,12-methano-1H,14bH-11,13-dioxacyclopenta[fg]naphth[2,1-b]octalene-1,10,14,18(6aH,14aH)-tetrone, 7,7a,8,9,12,12a,15,16,16a,16b-decahydro-7,14a-dihydroxy-8,9,12a,16b-tetramethyl-, [6aR-(6aα,7α,7aα,8α,9α,12α,12aβ,14aβ,14bβ,16aβ,16bα)]-
  • (6aR,7S,7aR,8S,9S,12R,12aS,14aR,14bR,16aS,16bR)-7,7a,8,9,12,12a,15,16,16a,16b-Decahydro-7,14a-dihydroxy-8,9,12a,16b-tetramethyl-14b,7-(epoxymethano)-8,12-methano-1H,14bH-11,13-dioxacyclopenta[fg]naphth[2,1-b]octalene-1,10,14,18(6aH,14aH)-tetrone
  • (25S)-25,27-Dihydro-4,7-didehydroneophysalin B
  • 25,27-Dihydro-4,7-didehydro-7-deoxyneophysalin A