Spiro[10,12:19,22a-dimethano-4H,5H,22aH-oxireno[8,9][1,6,12]trioxacyclooctadecino[3,4-d][1]benzopyran-11(10H),2′-oxirane]-2,14(1aH,17H)-dione, 6-(acetyloxy)-6,8a,11a,12,21,22-hexahydro-23-hydroxy-7,11a-dimethyl-, (1aS,2′S,4aR,6S,8aR,10R,11aS,12R,15Z,18Z,22aR,23S)-
CAS Registry Number®
99486-49-4
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CAS Name
Spiro[10,12:19,22a-dimethano-4H,5H,22aH-oxireno[8,9][1,6,12]trioxacyclooctadecino[3,4-d][1]benzopyran-11(10H),2′-oxirane]-2,14(1aH,17H)-dione, 6-(acetyloxy)-6,8a,11a,12,21,22-hexahydro-23-hydroxy-7,11a-dimethyl-, (1aS,2′S,4aR,6S,8aR,10R,11aS,12R,15Z,18Z,22aR,23S)-Molecular Formula
C29H34O11Molecular Mass
558.57Cite this Page
Spiro[10,12:19,22a-dimethano-4H,5H,22aH-oxireno[8,9][1,6,12]trioxacyclooctadecino[3,4-d][1]benzopyran-11(10H),2′-oxirane]-2,14(1aH,17H)-dione, 6-(acetyloxy)-6,8a,11a,12,21,22-hexahydro-23-hydroxy-7,11a-dimethyl-, (1aS,2′S,4aR,6S,8aR,10R,11aS,12R,15Z,18Z,22aR,23S)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=99486-49-4 (retrieved ) (CAS RN: 99486-49-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C29H34O11/c1-15-10-20-27(12-18(15)37-16(2)30)13-35-25(33)24-28(40-24)8-9-34-17(23(28)32)6-4-5-7-22(31)39-19-11-21(38-20)29(14-36-29)26(19,27)3/h5-7,10,18-21,23-24,32H,4,8-9,11-14H2,1-3H3/b7-5-,17-6+/t18-,19+,20+,21+,23-,24+,26?,27+,28+,29-/m0/s1
InChIKey
InChIKey=BDPRKFBFVAVFJK-BNNINPMLSA-N
SMILES
CC12[C@@]3([C@]4(C[C@]1(OC(=O)/C=C\C/C=C/5\[C@H](O)[C@@]6([C@@](C(=O)OC[C@]27[C@](O4)(C=C(C)[C@@H](OC(C)=O)C7)[H])(O6)[H])CCO5)[H])[H])CO3
Canonical SMILES
O=C1OC2CC3OC4C=C(C)C(OC(=O)C)CC4(COC(=O)C5OC65CCOC(=CCC=C1)C6O)C2(C)C73OC7
Other Names for this Substance
- Spiro[10,12:19,22a-dimethano-4H,5H,22aH-oxireno[8,9][1,6,12]trioxacyclooctadecino[3,4-d][1]benzopyran-11(10H),2′-oxirane]-2,14(1aH,17H)-dione, 6-(acetyloxy)-6,8a,11a,12,21,22-hexahydro-23-hydroxy-7,11a-dimethyl-, (1aS,2′S,4aR,6S,8aR,10R,11aS,12R,15Z,18Z,22aR,23S)-
- Satratoxin H, 8-(acetyloxy)-6′,7′-didehydro-6′-de(1-hydroxyethyl)-2′,3′-epoxy-2′,3′,7′,8′-tetrahydro-
- Myrotoxin B
- Spiro[10,12:19,22a-dimethano-4H,5H,22aH-oxireno[8,9][1,6,12]trioxacyclooctadecino[3,4-d][1]benzopyran-11(10H),2′-oxirane]-2,14(1aH,17H)-dione, 6-(acetyloxy)-6,8a,11a,12,21,22-hexahydro-23-hydroxy-7,11a-dimethyl-, [1aS-(1aR*,4aS*,6R*,8aS*,10S*,11R*,11aR*,12S*,15Z,18Z,22aS*,23R*)]-