Centratherin

CAS Registry Number®

71939-83-8

CAS Name

Centratherin

Molecular Formula

C20H22O7

Molecular Mass

374.38

Cite this Page

Centratherin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=71939-83-8 (retrieved 2024-11-23) (CAS RN: 71939-83-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H22O7/c1-5-10(2)18(23)26-15-8-20(4)16(22)7-13(27-20)12(9-21)6-14-17(15)11(3)19(24)25-14/h5-7,14-15,17,21H,3,8-9H2,1-2,4H3/b10-5-,12-6-/t14-,15+,17+,20-/m1/s1

InChIKey

InChIKey=BMVJFNLJSZHNNS-YUDFMKBLSA-N

SMILES

O(C(/C(=C\C)/C)=O)[C@@H]1[C@@]2([C@@](/C=C(/CO)\C=3O[C@](C)(C1)C(=O)C3)(OC(=O)C2=C)[H])[H]

Canonical SMILES

O=C(OC1CC2(OC(=CC2=O)C(=CC3OC(=O)C(=C)C31)CO)C)C(=CC)C

Other Names for this Substance

  • 2-Butenoic acid, 2-methyl-, (3aR,4S,6R,10Z,11aR)-2,3,3a,4,5,6,7,11a-octahydro-10-(hydroxymethyl)-6-methyl-3-methylene-2,7-dioxo-6,9-epoxycyclodeca[b]furan-4-yl ester, (2Z)-
  • 2-Butenoic acid, 2-methyl-, 2,3,3a,4,5,6,7,11a-octahydro-10-(hydroxymethyl)-6-methyl-3-methylene-2,7-dioxo-6,9-epoxycyclodeca[b]furan-4-yl ester, [3aR-[3aR*,4S*(Z),6R*,10Z,11aR*]]-
  • 6,9-Epoxycyclodeca[b]furan, 2-butenoic acid deriv.
  • Centratherin
  • Lychnophorolide A

Deleted or Replaced CAS Registry Numbers

80409-06-9, 80795-27-3

CAS INSIGHTSTM
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