Methyl (2Z)-3-[(3S,3aS,5aR,6R,6aR,9aS,9bR,9cR,10aS)-3-(3-furanyl)dodecahydro-6a,9a-dihydroxy-3a,6,8,8,9b-pentamethyl-1,7-dioxo-3H-furo[3′,2′:4,5]cyclopent[1,2-f]oxireno[d]-2-benzopyran-6-yl]-2-propenoate

CAS Registry Number®

62026-30-6

CAS Name

Methyl (2Z)-3-[(3S,3aS,5aR,6R,6aR,9aS,9bR,9cR,10aS)-3-(3-furanyl)dodecahydro-6a,9a-dihydroxy-3a,6,8,8,9b-pentamethyl-1,7-dioxo-3H-furo[3′,2′:4,5]cyclopent[1,2-f]oxireno[d]-2-benzopyran-6-yl]-2-propenoate

Molecular Formula

C27H32O10

Molecular Mass

516.54

Cite this Page

Methyl (2Z)-3-[(3S,3aS,5aR,6R,6aR,9aS,9bR,9cR,10aS)-3-(3-furanyl)dodecahydro-6a,9a-dihydroxy-3a,6,8,8,9b-pentamethyl-1,7-dioxo-3H-furo[3′,2′:4,5]cyclopent[1,2-f]oxireno[d]-2-benzopyran-6-yl]-2-propenoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=62026-30-6 (retrieved 2024-11-24) (CAS RN: 62026-30-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H32O10/c1-21(2)20(30)25(31)22(3,11-8-16(28)33-6)15-7-10-23(4)17(14-9-12-34-13-14)35-19(29)18-26(23,36-18)24(15,5)27(25,32)37-21/h8-9,11-13,15,17-18,31-32H,7,10H2,1-6H3/b11-8-/t15-,17+,18-,22-,23+,24-,25+,26-,27+/m1/s1

InChIKey

InChIKey=DYNIRWNERRSOEV-HPGFDZHLSA-N

SMILES

C[C@]12[C@]34[C@](C)([C@@H](OC(=O)[C@]3(O4)[H])C=5C=COC5)CC[C@@]1([C@](/C=C\C(OC)=O)(C)[C@]6(O)[C@@]2(O)OC(C)(C)C6=O)[H]

Canonical SMILES

O=C(OC)C=CC1(C)C2CCC3(C)C(OC(=O)C4OC43C2(C)C5(O)OC(C(=O)C51O)(C)C)C6=COC=C6

Other Names for this Substance

  • 2-Propenoic acid, 3-[(3S,3aS,5aR,6R,6aR,9aS,9bR,9cR,10aS)-3-(3-furanyl)dodecahydro-6a,9a-dihydroxy-3a,6,8,8,9b-pentamethyl-1,7-dioxo-3H-furo[3′,2′:4,5]cyclopent[1,2-f]oxireno[d]-2-benzopyran-6-yl]-, methyl ester, (2Z)-
  • 2-Propenoic acid, 3-[3-(3-furanyl)dodecahydro-6a,9a-dihydroxy-3a,6,8,8,9b-pentamethyl-1,7-dioxo-3H-furo[3′,2′:4,5]cyclopent[1,2-f]oxireno[d]-2-benzopyran-6-yl]-, methyl ester, [3S-[3α,3aα,5aα,6α(Z),6aβ,9aβ,9bβ,9cS*,10aα]]-
  • Methyl (2Z)-3-[(3S,3aS,5aR,6R,6aR,9aS,9bR,9cR,10aS)-3-(3-furanyl)dodecahydro-6a,9a-dihydroxy-3a,6,8,8,9b-pentamethyl-1,7-dioxo-3H-furo[3′,2′:4,5]cyclopent[1,2-f]oxireno[d]-2-benzopyran-6-yl]-2-propenoate
  • Harrisonin

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