2-Butenoic acid, 2-methyl-, (3S,3aR,4S,6S,6aR,7R,9aS,9bS)-3,6-bis(acetyloxy)-2,3,3a,4,5,6,6a,7,9a,9b-decahydro-3,6,9-trimethyl-4-[(2S)-2-methyl-1-oxobutoxy]-2-oxoazuleno[4,5-b]furan-7-yl ester, (2Z)-

CAS Registry Number®

41929-11-7
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CAS Name

2-Butenoic acid, 2-methyl-, (3S,3aR,4S,6S,6aR,7R,9aS,9bS)-3,6-bis(acetyloxy)-2,3,3a,4,5,6,6a,7,9a,9b-decahydro-3,6,9-trimethyl-4-[(2S)-2-methyl-1-oxobutoxy]-2-oxoazuleno[4,5-b]furan-7-yl ester, (2Z)-

Molecular Formula

C29H40O10

Molecular Mass

548.62

Cite this Page

2-Butenoic acid, 2-methyl-, (3S,3aR,4S,6S,6aR,7R,9aS,9bS)-3,6-bis(acetyloxy)-2,3,3a,4,5,6,6a,7,9a,9b-decahydro-3,6,9-trimethyl-4-[(2S)-2-methyl-1-oxobutoxy]-2-oxoazuleno[4,5-b]furan-7-yl ester, (2Z)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=41929-11-7 (retrieved 2024-05-18) (CAS RN: 41929-11-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C29H40O10/c1-10-14(3)25(32)35-19-12-16(5)21-22(19)28(8,38-17(6)30)13-20(36-26(33)15(4)11-2)23-24(21)37-27(34)29(23,9)39-18(7)31/h10,12,15,19-24H,11,13H2,1-9H3/b14-10-/t15-,19+,20-,21+,22-,23+,24-,28-,29-/m0/s1

InChIKey

InChIKey=VIFTUZUHQDHAIL-ZVMCODLXSA-N

SMILES

O(C([C@H](CC)C)=O)[C@@H]1[C@@]2([C@]([C@]3([C@@]([C@](OC(C)=O)(C)C1)([C@H](OC(/C(=C\C)/C)=O)C=C3C)[H])[H])(OC(=O)[C@]2(OC(C)=O)C)[H])[H]

Canonical SMILES

O=C(OC1C=C(C)C2C3OC(=O)C(OC(=O)C)(C)C3C(OC(=O)C(C)CC)CC(OC(=O)C)(C)C12)C(=CC)C

Other Names for this Substance

  • 2-Butenoic acid, 2-methyl-, (3S,3aR,4S,6S,6aR,7R,9aS,9bS)-3,6-bis(acetyloxy)-2,3,3a,4,5,6,6a,7,9a,9b-decahydro-3,6,9-trimethyl-4-[(2S)-2-methyl-1-oxobutoxy]-2-oxoazuleno[4,5-b]furan-7-yl ester, (2Z)-
  • Azuleno[4,5-b]furan, 2-butenoic acid deriv.
  • Archangelolide

Deleted or Replaced CAS Registry Numbers

104759-00-4

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